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Wednesday, February 1, 2012

http://ChemLookup.com Compounds

CAS RN: 145440-96-6
CAS Name: N-[2-(hydroxymethyl)-6-methylphenyl]-5-methyl-3-isoxazolecarboxamide
OPENEYE Name: N-[2-(hydroxymethyl)-6-methyl-phenyl]-5-methyl-isoxazole-3-carboxamide
IUPAC Name: N-[2-(hydroxymethyl)-6-methylphenyl]-5-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-[2-(hydroxymethyl)-6-methyl-phenyl]-5-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C13H14N2O3
MOLECULAR WEIGHT: 246.26186
SMILES: CC1=C(C(=CC=C1)CO)NC(=O)C2=NOC(=C2)C
Structure:

CAS RN: 145440-95-5
CAS Name: N-(2-amino-6-methylphenyl)-5-methyl-3-isoxazolecarboxamide
OPENEYE Name: N-(2-amino-6-methyl-phenyl)-5-methyl-isoxazole-3-carboxamide
IUPAC Name: N-(2-amino-6-methylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-(2-azanyl-6-methyl-phenyl)-5-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C12H13N3O2
MOLECULAR WEIGHT: 231.25052
SMILES: CC1=C(C(=CC=C1)N)NC(=O)C2=NOC(=C2)C
Structure:

CAS RN: 145440-94-4
CAS Name: 5-methyl-N-(2-methyl-6-nitrophenyl)-3-isoxazolecarboxamide
OPENEYE Name: 5-methyl-N-(2-methyl-6-nitro-phenyl)isoxazole-3-carboxamide
IUPAC Name: 5-methyl-N-(2-methyl-6-nitrophenyl)-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-methyl-N-(2-methyl-6-nitro-phenyl)-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C12H11N3O4
MOLECULAR WEIGHT: 261.23344
SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C2=NOC(=C2)C
Structure:

CAS RN: 145440-93-3
CAS Name: 3-methyl-2-[[(5-methyl-3-isoxazolyl)-oxomethyl]amino]benzoic acid
OPENEYE Name: 3-methyl-2-[(5-methylisoxazole-3-carbonyl)amino]benzoic acid
IUPAC Name: 3-methyl-2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]benzoic acid
SYSTEMATIC NAME: 3-methyl-2-[(5-methyl-1,2-oxazol-3-yl)carbonylamino]benzoic acid
MOLECULAR FORMULA: C13H12N2O4
MOLECULAR WEIGHT: 260.24538
SMILES: CC1=CC=CC(=C1NC(=O)C2=NOC(=C2)C)C(=O)O
Structure:

CAS RN: 145440-92-2
CAS Name: 3-methyl-2-[[(5-methyl-3-isoxazolyl)-oxomethyl]amino]benzoic acid ethyl ester
OPENEYE Name: ethyl 3-methyl-2-[(5-methylisoxazole-3-carbonyl)amino]benzoate
IUPAC Name: ethyl 3-methyl-2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]benzoate
SYSTEMATIC NAME: ethyl 3-methyl-2-[(5-methyl-1,2-oxazol-3-yl)carbonylamino]benzoate
MOLECULAR FORMULA: C15H16N2O4
MOLECULAR WEIGHT: 288.29854
SMILES: CCOC(=O)C1=C(C(=CC=C1)C)NC(=O)C2=NOC(=C2)C
Structure:

CAS RN: 145440-91-1
CAS Name: N-(3-bromo-2,6-dimethylphenyl)-5-methyl-3-isoxazolecarboxamide
OPENEYE Name: N-(3-bromo-2,6-dimethyl-phenyl)-5-methyl-isoxazole-3-carboxamide
IUPAC Name: N-(3-bromo-2,6-dimethylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-(3-bromanyl-2,6-dimethyl-phenyl)-5-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C13H13BrN2O2
MOLECULAR WEIGHT: 309.15852
SMILES: CC1=C(C(=C(C=C1)Br)C)NC(=O)C2=NOC(=C2)C
Structure:

CAS RN: 145440-90-0
CAS Name: 5-(hydroxymethyl)-N-(2,4,6-trimethylphenyl)-3-isoxazolecarboxamide
OPENEYE Name: 5-(hydroxymethyl)-N-(2,4,6-trimethylphenyl)isoxazole-3-carboxamide
IUPAC Name: 5-(hydroxymethyl)-N-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-(hydroxymethyl)-N-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C14H16N2O3
MOLECULAR WEIGHT: 260.28844
SMILES: CC1=CC(=C(C(=C1)C)NC(=O)C2=NOC(=C2)CO)C
Structure:

CAS RN: 145440-89-7
CAS Name: N-(2,6-dimethylphenyl)-5-phenyl-3-isoxazolecarboxamide
OPENEYE Name: N-(2,6-dimethylphenyl)-5-phenyl-isoxazole-3-carboxamide
IUPAC Name: N-(2,6-dimethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C18H16N2O2
MOLECULAR WEIGHT: 292.33184
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C2=NOC(=C2)C3=CC=CC=C3
Structure:

CAS RN: 145440-88-6
CAS Name: N-(2,6-dimethylphenyl)-5-(1-hydroxyethyl)-3-isoxazolecarboxamide
OPENEYE Name: N-(2,6-dimethylphenyl)-5-(1-hydroxyethyl)isoxazole-3-carboxamide
IUPAC Name: N-(2,6-dimethylphenyl)-5-(1-hydroxyethyl)-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-5-(1-hydroxyethyl)-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C14H16N2O3
MOLECULAR WEIGHT: 260.28844
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C2=NOC(=C2)C(C)O
Structure:

CAS RN: 145440-86-4
CAS Name: 5-methyl-N-(2-phenylphenyl)-3-isoxazolecarboxamide
OPENEYE Name: 5-methyl-N-(2-phenylphenyl)isoxazole-3-carboxamide
IUPAC Name: 5-methyl-N-(2-phenylphenyl)-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-methyl-N-(2-phenylphenyl)-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C17H14N2O2
MOLECULAR WEIGHT: 278.30526
SMILES: CC1=CC(=NO1)C(=O)NC2=CC=CC=C2C3=CC=CC=C3
Structure:

CAS RN: 145440-85-3
CAS Name: 5-methyl-N-[2-(trifluoromethyl)phenyl]-3-isoxazolecarboxamide
OPENEYE Name: 5-methyl-N-[2-(trifluoromethyl)phenyl]isoxazole-3-carboxamide
IUPAC Name: 5-methyl-N-[2-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-methyl-N-[2-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C12H9F3N2O2
MOLECULAR WEIGHT: 270.20727
SMILES: CC1=CC(=NO1)C(=O)NC2=CC=CC=C2C(F)(F)F
Structure:

CAS RN: 145430-08-6
CAS Name: N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamic acid 3-methylbutyl ester
OPENEYE Name: isopentyl N-[1-diphenylphosphoryl-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]carbamate
IUPAC Name: 3-methylbutyl N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
SYSTEMATIC NAME: 3-methylbutyl N-[2-diphenylphosphoryl-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]carbamate
MOLECULAR FORMULA: C21H22F6NO3P
MOLECULAR WEIGHT: 481.36846
SMILES: CC(C)CCOC(=O)NC(C(F)(F)F)(C(F)(F)F)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:

CAS RN: 145430-07-5
CAS Name: N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamic acid butyl ester
OPENEYE Name: butyl N-[1-diphenylphosphoryl-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]carbamate
IUPAC Name: butyl N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
SYSTEMATIC NAME: butyl N-[2-diphenylphosphoryl-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]carbamate
MOLECULAR FORMULA: C20H20F6NO3P
MOLECULAR WEIGHT: 467.34188
SMILES: CCCCOC(=O)NC(C(F)(F)F)(C(F)(F)F)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:

CAS RN: 145430-05-3
CAS Name: N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[1-diphenylphosphoryl-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]carbamate
IUPAC Name: benzyl N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[2-diphenylphosphoryl-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]carbamate
MOLECULAR FORMULA: C23H18F6NO3P
MOLECULAR WEIGHT: 501.3581
SMILES: C1=CC=C(C=C1)COC(=O)NC(C(F)(F)F)(C(F)(F)F)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 145430-04-2
CAS Name: N-[2-di(propan-2-yloxy)phosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl]carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[1-diisopropoxyphosphoryl-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]carbamate
IUPAC Name: benzyl N-[2-di(propan-2-yloxy)phosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[2-di(propan-2-yloxy)phosphoryl-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]carbamate
MOLECULAR FORMULA: C17H22F6NO5P
MOLECULAR WEIGHT: 465.32446
SMILES: CC(C)OP(=O)(C(C(F)(F)F)(C(F)(F)F)NC(=O)OCC1=CC=CC=C1)OC(C)C
Structure:

CAS RN: 145430-03-1
CAS Name: N-(2-diethoxyphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[1-diethoxyphosphoryl-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]carbamate
IUPAC Name: benzyl N-(2-diethoxyphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[2-diethoxyphosphoryl-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]carbamate
MOLECULAR FORMULA: C15H18F6NO5P
MOLECULAR WEIGHT: 437.2713
SMILES: CCOP(=O)(C(C(F)(F)F)(C(F)(F)F)NC(=O)OCC1=CC=CC=C1)OCC
Structure:

CAS RN: 145410-51-1
CAS Name: 1-(cyclohexylmethyl)-3-(2,6-diethylphenyl)-1-(4-phenylcyclohexyl)urea
OPENEYE Name: 1-(cyclohexylmethyl)-3-(2,6-diethylphenyl)-1-(4-phenylcyclohexyl)urea
IUPAC Name: 1-(cyclohexylmethyl)-3-(2,6-diethylphenyl)-1-(4-phenylcyclohexyl)urea
SYSTEMATIC NAME: 1-(cyclohexylmethyl)-3-(2,6-diethylphenyl)-1-(4-phenylcyclohexyl)urea
MOLECULAR FORMULA: C30H42N2O
MOLECULAR WEIGHT: 446.66728
SMILES: CCC1=C(C(=CC=C1)CC)NC(=O)N(CC2CCCCC2)C3CCC(CC3)C4=CC=CC=C4
Structure:

CAS RN: 145410-26-0
CAS Name: 3-[2,6-di(propan-2-yl)phenyl]-1-(4-phenylcyclohexyl)-1-(phenylmethyl)urea
OPENEYE Name: 1-benzyl-3-(2,6-diisopropylphenyl)-1-(4-phenylcyclohexyl)urea
IUPAC Name: 1-benzyl-3-[2,6-di(propan-2-yl)phenyl]-1-(4-phenylcyclohexyl)urea
SYSTEMATIC NAME: 3-[2,6-di(propan-2-yl)phenyl]-1-(4-phenylcyclohexyl)-1-(phenylmethyl)urea
MOLECULAR FORMULA: C32H40N2O
MOLECULAR WEIGHT: 468.6728
SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)N(CC2=CC=CC=C2)C3CCC(CC3)C4=CC=CC=C4
Structure:

CAS RN: 145316-21-8
CAS Name: 2-(2-imino-[1,3]thiazino[3,2-a]benzimidazol-4-yl)-2-propanol hydrochloride
OPENEYE Name: 2-(2-imino-[1,3]thiazino[3,2-a]benzimidazol-4-yl)propan-2-ol hydrochloride
IUPAC Name: 2-(2-imino-[1,3]thiazino[3,2-a]benzimidazol-4-yl)propan-2-ol hydrochloride
SYSTEMATIC NAME: 2-(2-azanylidene-[1,3]thiazino[3,2-a]benzimidazol-4-yl)propan-2-ol hydrochloride
MOLECULAR FORMULA: C13H14ClN3OS
MOLECULAR WEIGHT: 295.78776
SMILES: CC(C)(C1=CC(=N)SC2=NC3=CC=CC=C3N12)O.Cl
Structure:

CAS RN: 145313-41-3
CAS Name: 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1H-indol-3-yl]acetic acid methyl ester hydrochloride
OPENEYE Name: methyl 2-[4-[2-hydroxy-3-(isopropylamino)propoxy]-1H-indol-3-yl]acetate hydrochloride
IUPAC Name: methyl 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1H-indol-3-yl]acetate hydrochloride
SYSTEMATIC NAME: methyl 2-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-1H-indol-3-yl]ethanoate hydrochloride
MOLECULAR FORMULA: C17H25ClN2O4
MOLECULAR WEIGHT: 356.8444
SMILES: CC(C)NCC(COC1=CC=CC2=C1C(=CN2)CC(=O)OC)O.Cl
Structure:

CAS RN: 145296-57-7
CAS Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-1H-indol-3-yl]-N-(propan-2-ylideneamino)acetamide hydrochloride
OPENEYE Name: 2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-1H-indol-3-yl]-N-(isopropylideneamino)acetamide hydrochloride
IUPAC Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-1H-indol-3-yl]-N-(propan-2-ylideneamino)acetamide hydrochloride
SYSTEMATIC NAME: 2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-1H-indol-3-yl]-N-(propan-2-ylideneamino)ethanamide hydrochloride
MOLECULAR FORMULA: C20H31ClN4O3
MOLECULAR WEIGHT: 410.93814
SMILES: CC(=NNC(=O)CC1=CNC2=C1C(=CC=C2)OCC(CNC(C)(C)C)O)C.Cl
Structure:

CAS RN: 145296-54-4
CAS Name: 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1H-indol-3-yl]acetamide hydrochloride
OPENEYE Name: 2-[4-[2-hydroxy-3-(isopropylamino)propoxy]-1H-indol-3-yl]acetamide hydrochloride
IUPAC Name: 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1H-indol-3-yl]acetamide hydrochloride
SYSTEMATIC NAME: 2-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-1H-indol-3-yl]ethanamide hydrochloride
MOLECULAR FORMULA: C16H24ClN3O3
MOLECULAR WEIGHT: 341.83306
SMILES: CC(C)NCC(COC1=CC=CC2=C1C(=CN2)CC(=O)N)O.Cl
Structure:

CAS RN: 145296-53-3
CAS Name: 1-(tert-butylamino)-3-[(3-methyl-1H-indol-4-yl)oxy]-2-propanol hydrochloride
OPENEYE Name: 1-(tert-butylamino)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol hydrochloride
IUPAC Name: 1-(tert-butylamino)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol hydrochloride
SYSTEMATIC NAME: 1-(tert-butylamino)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol hydrochloride
MOLECULAR FORMULA: C16H25ClN2O2
MOLECULAR WEIGHT: 312.8349
SMILES: CC1=CNC2=C1C(=CC=C2)OCC(CNC(C)(C)C)O.Cl
Structure:

CAS RN: 145296-52-2
CAS Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-1H-indol-3-yl]acetic acid methyl ester hydrochloride
OPENEYE Name: methyl 2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-1H-indol-3-yl]acetate hydrochloride
IUPAC Name: methyl 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-1H-indol-3-yl]acetate hydrochloride
SYSTEMATIC NAME: methyl 2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-1H-indol-3-yl]ethanoate hydrochloride
MOLECULAR FORMULA: C18H27ClN2O4
MOLECULAR WEIGHT: 370.87098
SMILES: CC(C)(C)NCC(COC1=CC=CC2=C1C(=CN2)CC(=O)OC)O.Cl
Structure:

CAS RN: 145296-51-1
CAS Name: 1-[(3-methyl-1H-indol-4-yl)oxy]-3-(propan-2-ylamino)-2-propanol hydrochloride
OPENEYE Name: 1-(isopropylamino)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol hydrochloride
IUPAC Name: 1-[(3-methyl-1H-indol-4-yl)oxy]-3-(propan-2-ylamino)propan-2-ol hydrochloride
SYSTEMATIC NAME: 1-[(3-methyl-1H-indol-4-yl)oxy]-3-(propan-2-ylamino)propan-2-ol hydrochloride
MOLECULAR FORMULA: C15H23ClN2O2
MOLECULAR WEIGHT: 298.80832
SMILES: CC1=CNC2=C1C(=CC=C2)OCC(CNC(C)C)O.Cl
Structure:

CAS RN: 145278-91-7
CAS Name: 2-chloro-N-(2-chloroethyl)-N-[phenoxy-[2-(2,2,6,6-tetramethyl-1-oxo-4-piperidin-1-iumylidene)hydrazinyl]phosphoryl]ethanamine chloride
OPENEYE Name: 2-chloro-N-(2-chloroethyl)-N-[phenoxy-[2-(2,2,6,6-tetramethyl-1-oxo-piperidin-1-ium-4-ylidene)hydrazino]phosphoryl]ethanamine chloride
IUPAC Name: 2-chloro-N-(2-chloroethyl)-N-[phenoxy-[2-(2,2,6,6-tetramethyl-1-oxopiperidin-1-ium-4-ylidene)hydrazinyl]phosphoryl]ethanamine chloride
SYSTEMATIC NAME: 2-chloranyl-N-(2-chloroethyl)-N-[phenoxy-[2-(2,2,6,6-tetramethyl-1-oxidanylidene-piperidin-1-ium-4-ylidene)hydrazinyl]phosphoryl]ethanamine chloride
MOLECULAR FORMULA: C19H30Cl3N4O3P
MOLECULAR WEIGHT: 499.799261
SMILES: CC1(CC(=NNP(=O)(N(CCCl)CCCl)OC2=CC=CC=C2)CC([N+]1=O)(C)C)C.[Cl-]
Structure:

CAS RN: 145278-90-6
CAS Name: 2-chloro-N-(2-chloroethyl)-N-[[2-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-4-piperidinylidene)hydrazinyl]-(4-methylphenoxy)phosphoryl]ethanamine
OPENEYE Name: 2-chloro-N-(2-chloroethyl)-N-[[2-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-4-piperidylidene)hydrazino]-(4-methylphenoxy)phosphoryl]ethanamine
IUPAC Name: 2-chloro-N-(2-chloroethyl)-N-[[2-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethylpiperidin-4-ylidene)hydrazinyl]-(4-methylphenoxy)phosphoryl]ethanamine
SYSTEMATIC NAME: 2-chloranyl-N-(2-chloroethyl)-N-[[2-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-piperidin-4-ylidene)hydrazinyl]-(4-methylphenoxy)phosphoryl]ethanamine
MOLECULAR FORMULA: C20H32Cl2N4O3P
MOLECULAR WEIGHT: 478.372841
SMILES: CC1=CC=C(C=C1)OP(=O)(NN=C2CC(N(C(C2)(C)C)[O])(C)C)N(CCCl)CCCl
Structure:

CAS RN: 145278-80-4
CAS Name: 2-methyl-1-nonyl-4,5-dihydroimidazole; oxalic acid
OPENEYE Name: 2-methyl-1-nonyl-4,5-dihydroimidazole; oxalic acid
IUPAC Name: 2-methyl-1-nonyl-4,5-dihydroimidazole; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; 2-methyl-1-nonyl-4,5-dihydroimidazole
MOLECULAR FORMULA: C15H28N2O4
MOLECULAR WEIGHT: 300.39382
SMILES: CCCCCCCCCN1CCN=C1C.C(=O)(C(=O)O)O
Structure:

CAS RN: 145253-62-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H18N2O
MOLECULAR WEIGHT: 266.33762
SMILES: C1CC2=CC=CC=C2C(C3=CC=CC=C31)NCC(=O)N
Structure:

CAS RN: 145232-74-2
CAS Name: 9,10-dioxo-N-[[2-[1-(phenylmethyl)-4-piperidinyl]ethylamino]-sulfanylidenemethyl]-2-anthracenecarboxamide hydrochloride
OPENEYE Name: N-[2-(1-benzyl-4-piperidyl)ethylcarbamothioyl]-9,10-dioxo-anthracene-2-carboxamide hydrochloride
IUPAC Name: N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]-9,10-dioxoanthracene-2-carboxamide hydrochloride
SYSTEMATIC NAME: 9,10-bis(oxidanylidene)-N-[2-[1-(phenylmethyl)piperidin-4-yl]ethylcarbamothioyl]anthracene-2-carboxamide hydrochloride
MOLECULAR FORMULA: C30H30ClN3O3S
MOLECULAR WEIGHT: 548.0955
SMILES: C1CN(CCC1CCNC(=S)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)CC5=CC=CC=C5.Cl
Structure:

CAS RN: 145232-89-9
CAS Name: N-[[2-[1-(phenylmethyl)-4-piperidinyl]ethylamino]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide
OPENEYE Name: N-[2-(1-benzyl-4-piperidyl)ethylcarbamothioyl]-1,3-benzodioxole-5-carboxamide
IUPAC Name: N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]-1,3-benzodioxole-5-carboxamide
SYSTEMATIC NAME: N-[2-[1-(phenylmethyl)piperidin-4-yl]ethylcarbamothioyl]-1,3-benzodioxole-5-carboxamide
MOLECULAR FORMULA: C23H27N3O3S
MOLECULAR WEIGHT: 425.54378
SMILES: C1CN(CCC1CCNC(=S)NC(=O)C2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4
Structure:

CAS RN: 145232-73-1
CAS Name: N-[[2-[1-(phenylmethyl)-4-piperidinyl]ethylamino]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide hydrochloride
OPENEYE Name: N-[2-(1-benzyl-4-piperidyl)ethylcarbamothioyl]-1,3-benzodioxole-5-carboxamide hydrochloride
IUPAC Name: N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]-1,3-benzodioxole-5-carboxamide hydrochloride
SYSTEMATIC NAME: N-[2-[1-(phenylmethyl)piperidin-4-yl]ethylcarbamothioyl]-1,3-benzodioxole-5-carboxamide hydrochloride
MOLECULAR FORMULA: C23H28ClN3O3S
MOLECULAR WEIGHT: 462.00472
SMILES: C1CN(CCC1CCNC(=S)NC(=O)C2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4.Cl
Structure:

CAS RN: 145232-63-9
CAS Name: 3-nitro-N-[[2-[1-(phenylmethyl)-4-piperidinyl]ethylamino]-sulfanylidenemethyl]benzamide hydrochloride
OPENEYE Name: N-[2-(1-benzyl-4-piperidyl)ethylcarbamothioyl]-3-nitro-benzamide hydrochloride
IUPAC Name: N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]-3-nitrobenzamide hydrochloride
SYSTEMATIC NAME: 3-nitro-N-[2-[1-(phenylmethyl)piperidin-4-yl]ethylcarbamothioyl]benzamide hydrochloride
MOLECULAR FORMULA: C22H27ClN4O3S
MOLECULAR WEIGHT: 462.99278
SMILES: C1CN(CCC1CCNC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CC=C3.Cl
Structure:

http://ChemLookup.com Compounds

CAS RN: 145441-09-4
CAS Name: N-(2,6-dimethylphenyl)-3-methoxy-5-isoxazolecarboxamide
OPENEYE Name: N-(2,6-dimethylphenyl)-3-methoxy-isoxazole-5-carboxamide
IUPAC Name: N-(2,6-dimethylphenyl)-3-methoxy-1,2-oxazole-5-carboxamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-3-methoxy-1,2-oxazole-5-carboxamide
MOLECULAR FORMULA: C13H14N2O3
MOLECULAR WEIGHT: 246.26186
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=NO2)OC
Structure:

CAS RN: 145441-08-3
CAS Name: N-(2,6-dimethylphenyl)-5-isoxazolecarboxamide
OPENEYE Name: N-(2,6-dimethylphenyl)isoxazole-5-carboxamide
IUPAC Name: N-(2,6-dimethylphenyl)-1,2-oxazole-5-carboxamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-1,2-oxazole-5-carboxamide
MOLECULAR FORMULA: C12H12N2O2
MOLECULAR WEIGHT: 216.23588
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C2=CC=NO2
Structure:

CAS RN: 145441-07-2
CAS Name: 3-[(2,6-dimethylphenoxy)methyl]-5-methylisoxazole
OPENEYE Name: 3-[(2,6-dimethylphenoxy)methyl]-5-methyl-isoxazole
IUPAC Name: 3-[(2,6-dimethylphenoxy)methyl]-5-methyl-1,2-oxazole
SYSTEMATIC NAME: 3-[(2,6-dimethylphenoxy)methyl]-5-methyl-1,2-oxazole
MOLECULAR FORMULA: C13H15NO2
MOLECULAR WEIGHT: 217.2637
SMILES: CC1=C(C(=CC=C1)C)OCC2=NOC(=C2)C
Structure:

CAS RN: 145441-06-1
CAS Name: 5-methyl-3-isoxazolecarboxylic acid (2,6-dimethylphenyl) ester
OPENEYE Name: (2,6-dimethylphenyl) 5-methylisoxazole-3-carboxylate
IUPAC Name: (2,6-dimethylphenyl) 5-methyl-1,2-oxazole-3-carboxylate
SYSTEMATIC NAME: (2,6-dimethylphenyl) 5-methyl-1,2-oxazole-3-carboxylate
MOLECULAR FORMULA: C13H13NO3
MOLECULAR WEIGHT: 231.24722
SMILES: CC1=C(C(=CC=C1)C)OC(=O)C2=NOC(=C2)C
Structure:

CAS RN: 145441-05-0
CAS Name: 2,4,6-trimethyl-N-(5-methyl-3-isoxazolyl)benzamide
OPENEYE Name: 2,4,6-trimethyl-N-(5-methylisoxazol-3-yl)benzamide
IUPAC Name: 2,4,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SYSTEMATIC NAME: 2,4,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
MOLECULAR FORMULA: C14H16N2O2
MOLECULAR WEIGHT: 244.28904
SMILES: CC1=CC(=C(C(=C1)C)C(=O)NC2=NOC(=C2)C)C
Structure:

CAS RN: 145441-01-6
CAS Name: 5-methyl-N-(1-phenylethyl)-3-isoxazolecarboxamide
OPENEYE Name: 5-methyl-N-(1-phenylethyl)isoxazole-3-carboxamide
IUPAC Name: 5-methyl-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-methyl-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C13H14N2O2
MOLECULAR WEIGHT: 230.26246
SMILES: CC1=CC(=NO1)C(=O)NC(C)C2=CC=CC=C2
Structure:

CAS RN: 145441-02-7
CAS Name: 5-methyl-N-(1-phenylethyl)-3-isoxazolecarboxamide
OPENEYE Name: 5-methyl-N-(1-phenylethyl)isoxazole-3-carboxamide
IUPAC Name: 5-methyl-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-methyl-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C13H14N2O2
MOLECULAR WEIGHT: 230.26246
SMILES: CC1=CC(=NO1)C(=O)NC(C)C2=CC=CC=C2
Structure:

CAS RN: 145441-03-8
CAS Name: 5-methyl-N-(1-phenylethyl)-3-isoxazolecarboxamide
OPENEYE Name: 5-methyl-N-(1-phenylethyl)isoxazole-3-carboxamide
IUPAC Name: 5-methyl-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-methyl-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C13H14N2O2
MOLECULAR WEIGHT: 230.26246
SMILES: CC1=CC(=NO1)C(=O)NC(C)C2=CC=CC=C2
Structure:

CAS RN: 145440-99-9
CAS Name: N-[2-(diethylamino)ethyl]-N-(2,6-dimethylphenyl)-5-methyl-3-isoxazolecarboxamide
OPENEYE Name: N-[2-(diethylamino)ethyl]-N-(2,6-dimethylphenyl)-5-methyl-isoxazole-3-carboxamide
IUPAC Name: N-[2-(diethylamino)ethyl]-N-(2,6-dimethylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-[2-(diethylamino)ethyl]-N-(2,6-dimethylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C19H27N3O2
MOLECULAR WEIGHT: 329.43658
SMILES: CCN(CC)CCN(C1=C(C=CC=C1C)C)C(=O)C2=NOC(=C2)C
Structure:

CAS RN: 145440-98-8
CAS Name: N-(2,5-dimethoxyphenyl)-5-methyl-3-isoxazolecarboxamide
OPENEYE Name: N-(2,5-dimethoxyphenyl)-5-methyl-isoxazole-3-carboxamide
IUPAC Name: N-(2,5-dimethoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-(2,5-dimethoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C13H14N2O4
MOLECULAR WEIGHT: 262.26126
SMILES: CC1=CC(=NO1)C(=O)NC2=C(C=CC(=C2)OC)OC
Structure:

CAS RN: 145440-97-7
CAS Name: N-(2,6-dichlorophenyl)-5-methyl-3-isoxazolecarboxamide
OPENEYE Name: N-(2,6-dichlorophenyl)-5-methyl-isoxazole-3-carboxamide
IUPAC Name: N-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-[2,6-bis(chloranyl)phenyl]-5-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C11H8Cl2N2O2
MOLECULAR WEIGHT: 271.09942
SMILES: CC1=CC(=NO1)C(=O)NC2=C(C=CC=C2Cl)Cl
Structure:

http://ChemLookup.com Compounds

CAS RN: 145787-27-5
CAS Name: 4,6-dimethyl-1,1-dioxo-2-[3-[4-(2-pyridinyl)-1-piperazinyl]propyl]-3-isothiazolo[5,4-b]pyridinone
OPENEYE Name: 4,6-dimethyl-1,1-dioxo-2-[3-[4-(2-pyridyl)piperazin-1-yl]propyl]isothiazolo[5,4-b]pyridin-3-one
IUPAC Name: 4,6-dimethyl-1,1-dioxo-2-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-[1,2]thiazolo[5,4-b]pyridin-3-one
SYSTEMATIC NAME: 4,6-dimethyl-1,1-bis(oxidanylidene)-2-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-[1,2]thiazolo[5,4-b]pyridin-3-one
MOLECULAR FORMULA: C20H25N5O3S
MOLECULAR WEIGHT: 415.5092
SMILES: CC1=CC(=NC2=C1C(=O)N(S2(=O)=O)CCCN3CCN(CC3)C4=CC=CC=N4)C
Structure:

CAS RN: 145787-26-4
CAS Name: 4,6-dimethyl-1,1-dioxo-2-[3-(4-phenyl-1-piperazinyl)propyl]-3-isothiazolo[5,4-b]pyridinone
OPENEYE Name: 4,6-dimethyl-1,1-dioxo-2-[3-(4-phenylpiperazin-1-yl)propyl]isothiazolo[5,4-b]pyridin-3-one
IUPAC Name: 4,6-dimethyl-1,1-dioxo-2-[3-(4-phenylpiperazin-1-yl)propyl]-[1,2]thiazolo[5,4-b]pyridin-3-one
SYSTEMATIC NAME: 4,6-dimethyl-1,1-bis(oxidanylidene)-2-[3-(4-phenylpiperazin-1-yl)propyl]-[1,2]thiazolo[5,4-b]pyridin-3-one
MOLECULAR FORMULA: C21H26N4O3S
MOLECULAR WEIGHT: 414.52114
SMILES: CC1=CC(=NC2=C1C(=O)N(S2(=O)=O)CCCN3CCN(CC3)C4=CC=CC=C4)C
Structure:

CAS RN: 145759-35-9
CAS Name: N-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-N-methyl-1,2-benzothiazole-3-carboxamide hydrochloride
OPENEYE Name: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-N-methyl-1,2-benzothiazole-3-carboxamide hydrochloride
IUPAC Name: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-N-methyl-1,2-benzothiazole-3-carboxamide hydrochloride
SYSTEMATIC NAME: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-N-methyl-1,2-benzothiazole-3-carboxamide hydrochloride
MOLECULAR FORMULA: C24H28ClN5OS2
MOLECULAR WEIGHT: 502.09502
SMILES: CN(CCCCN1CCN(CC1)C2=NSC3=CC=CC=C32)C(=O)C4=NSC5=CC=CC=C54.Cl
Structure:

CAS RN: 145759-34-8
CAS Name: N-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-1,2-benzothiazole-3-carboxamide hydrochloride
OPENEYE Name: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1,2-benzothiazole-3-carboxamide hydrochloride
IUPAC Name: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1,2-benzothiazole-3-carboxamide hydrochloride
SYSTEMATIC NAME: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1,2-benzothiazole-3-carboxamide hydrochloride
MOLECULAR FORMULA: C23H26ClN5OS2
MOLECULAR WEIGHT: 488.06844
SMILES: C1CN(CCN1CCCCNC(=O)C2=NSC3=CC=CC=C32)C4=NSC5=CC=CC=C54.Cl
Structure:

CAS RN: 145697-93-4
CAS Name: (5R,6S)-3-[(1-acetyl-4-piperidinyl)thio]-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
OPENEYE Name: (5R,6S)-3-[(1-acetyl-4-piperidyl)sulfanyl]-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
IUPAC Name: (5R,6S)-3-(1-acetylpiperidin-4-yl)sulfanyl-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
SYSTEMATIC NAME: (5R,6S)-3-(1-ethanoylpiperidin-4-yl)sulfanyl-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C16H22N2O5S
MOLECULAR WEIGHT: 354.42128
SMILES: C[C@H]([C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)SC3CCN(CC3)C(=O)C)O
Structure:

CAS RN: 145657-33-6
CAS Name: 3-(2,3-difluoroanilino)-1-cyclohex-2-enone
OPENEYE Name: 3-(2,3-difluoroanilino)cyclohex-2-en-1-one
IUPAC Name: 3-(2,3-difluoroanilino)cyclohex-2-en-1-one
SYSTEMATIC NAME: 3-[[2,3-bis(fluoranyl)phenyl]amino]cyclohex-2-en-1-one
MOLECULAR FORMULA: C12H11F2NO
MOLECULAR WEIGHT: 223.218646
SMILES: C1CC(=CC(=O)C1)NC2=C(C(=CC=C2)F)F
Structure:

CAS RN: 145657-29-0
CAS Name: 3-(2-nitroanilino)-1-cyclohex-2-enone
OPENEYE Name: 3-(2-nitroanilino)cyclohex-2-en-1-one
IUPAC Name: 3-(2-nitroanilino)cyclohex-2-en-1-one
SYSTEMATIC NAME: 3-[(2-nitrophenyl)amino]cyclohex-2-en-1-one
MOLECULAR FORMULA: C12H12N2O3
MOLECULAR WEIGHT: 232.23528
SMILES: C1CC(=CC(=O)C1)NC2=CC=CC=C2[N+](=O)[O-]
Structure:

CAS RN: 145657-26-7
CAS Name: 3-(2,3-dichloroanilino)-1-cyclohex-2-enone
OPENEYE Name: 3-(2,3-dichloroanilino)cyclohex-2-en-1-one
IUPAC Name: 3-(2,3-dichloroanilino)cyclohex-2-en-1-one
SYSTEMATIC NAME: 3-[[2,3-bis(chloranyl)phenyl]amino]cyclohex-2-en-1-one
MOLECULAR FORMULA: C12H11Cl2NO
MOLECULAR WEIGHT: 256.12784
SMILES: C1CC(=CC(=O)C1)NC2=C(C(=CC=C2)Cl)Cl
Structure:

CAS RN: 145611-62-7
CAS Name: N-[(2S)-4-methyl-1-oxo-1-[[6-oxo-6-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)hexyl]amino]pentan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[(1S)-3-methyl-1-[[6-oxo-6-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)hexyl]carbamoyl]butyl]carbamate
IUPAC Name: tert-butyl N-[(2S)-4-methyl-1-oxo-1-[[6-oxo-6-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)hexyl]amino]pentan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2S)-4-methyl-1-oxidanylidene-1-[[6-oxidanylidene-6-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)hexyl]amino]pentan-2-yl]carbamate
MOLECULAR FORMULA: C31H51N3O8
MOLECULAR WEIGHT: 593.75194
SMILES: CC(C)C[C@@H](C(=O)NCCCCCC(=O)N1CCOCCOC2=CC=CC=C2OCCOCC1)NC(=O)OC(C)(C)C
Structure:

CAS RN: 145594-64-5
CAS Name: (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[(2R)-2-hydroxypropyl] ester O3-methyl ester
OPENEYE Name: O5-[(2R)-2-hydroxypropyl] O3-methyl (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
IUPAC Name: 5-O-[(2R)-2-hydroxypropyl] 3-O-methyl (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
SYSTEMATIC NAME: O3-methyl O5-[(2R)-2-oxidanylpropyl] (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
MOLECULAR FORMULA: C19H22N2O7
MOLECULAR WEIGHT: 390.38718
SMILES: CC1=C([C@@H](C(=C(N1)C)C(=O)OC[C@@H](C)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC
Structure:

CAS RN: 145594-63-4
CAS Name: (4R)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[(2R)-2-hydroxypropyl] ester O3-methyl ester
OPENEYE Name: O5-[(2R)-2-hydroxypropyl] O3-methyl (4R)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
IUPAC Name: 5-O-[(2R)-2-hydroxypropyl] 3-O-methyl (4R)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
SYSTEMATIC NAME: O3-methyl O5-[(2R)-2-oxidanylpropyl] (4R)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
MOLECULAR FORMULA: C19H22N2O7
MOLECULAR WEIGHT: 390.38718
SMILES: CC1=C([C@H](C(=C(N1)C)C(=O)OC[C@@H](C)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC
Structure:

CAS RN: 145594-62-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H9Cl2NO4
MOLECULAR WEIGHT: 338.14226
SMILES: C1C2=C(C(C3=C(N2)COC3=O)C4=C(C=C(C=C4)Cl)Cl)C(=O)O1
Structure:

CAS RN: 145594-61-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H13NO5
MOLECULAR WEIGHT: 299.27812
SMILES: COC1=CC=C(C=C1)C2C3=C(COC3=O)NC4=C2C(=O)OC4
Structure:

CAS RN: 145594-60-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H10INO4
MOLECULAR WEIGHT: 395.14867
SMILES: C1C2=C(C(C3=C(N2)COC3=O)C4=CC=C(C=C4)I)C(=O)O1
Structure:

CAS RN: 145594-59-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H10BrNO4
MOLECULAR WEIGHT: 348.1482
SMILES: C1C2=C(C(C3=C(N2)COC3=O)C4=CC=C(C=C4)Br)C(=O)O1
Structure:

CAS RN: 145594-58-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H10BrNO4
MOLECULAR WEIGHT: 348.1482
SMILES: C1C2=C(C(C3=C(N2)COC3=O)C4=CC(=CC=C4)Br)C(=O)O1
Structure:

CAS RN: 145594-43-0
CAS Name: (2S)-N-[(2S)-3-(4H-imidazol-4-yl)-1-oxo-1-[[oxo-[(2S)-1-[6-oxo-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)hexyl]-2-pyrrolidinyl]methyl]amino]propan-2-yl]-5-oxo-2-pyrrolidinecarboxamide hydrochloride
OPENEYE Name: (2S)-N-[(1S)-1-(4H-imidazol-4-ylmethyl)-2-oxo-2-[[(2S)-1-[6-oxo-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)hexyl]pyrrolidine-2-carbonyl]amino]ethyl]-5-oxo-pyrrolidine-2-carboxamide hydrochloride
IUPAC Name: (2S)-N-[(2S)-3-(4H-imidazol-4-yl)-1-oxo-1-[[(2S)-1-[6-oxo-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)hexyl]pyrrolidine-2-carbonyl]amino]propan-2-yl]-5-oxopyrrolidine-2-carboxamide hydrochloride
SYSTEMATIC NAME: (2S)-N-[(2S)-3-(4H-imidazol-4-yl)-1-oxidanylidene-1-[[(2S)-1-[6-oxidanylidene-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)hexyl]pyrrolidin-2-yl]carbonylamino]propan-2-yl]-5-oxidanylidene-pyrrolidine-2-carboxamide hydrochloride
MOLECULAR FORMULA: C32H52ClN7O9
MOLECULAR WEIGHT: 714.24978
SMILES: C1C[C@H](N(C1)CCCCCC(=O)N2CCOCCOCCOCCOCC2)C(=O)NC(=O)[C@H](CC3C=NC=N3)NC(=O)[C@@H]4CCC(=O)N4.Cl
Structure:

CAS RN: 145594-21-4
CAS Name: (2S)-2-amino-3-(4-hydroxyphenyl)-N-[(2R)-1-[[2-[[(2S)-2-[[(2S)-4-methyl-1-oxo-1-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)pentan-2-yl]amino]-1-oxo-3-phenylpropyl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]propanamide hydrochlo
OPENEYE Name: (2S)-2-amino-3-(4-hydroxyphenyl)-N-[(1R)-1-methyl-2-[[2-[[(2S)-2-[[(1S)-3-methyl-1-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-triene-8-carbonyl)butyl]amino]-3-phenyl-propanoyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]propanamide hydrochlori
IUPAC Name: (2S)-2-amino-3-(4-hydroxyphenyl)-N-[(2R)-1-[[2-[[(2S)-2-[[(2S)-4-methyl-1-oxo-1-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)pentan-2-yl]amino]-3-phenylpropanoyl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]propanamide hydrochlorid
SYSTEMATIC NAME: (2S)-2-azanyl-3-(4-hydroxyphenyl)-N-[(2R)-1-[[2-[[(2S)-2-[[(2S)-4-methyl-1-oxidanylidene-1-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)pentan-2-yl]amino]-3-phenyl-propanoyl]amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-pr
MOLECULAR FORMULA: C43H59ClN6O10
MOLECULAR WEIGHT: 855.41576
SMILES: C[C@H](C(=O)NCC(=O)NC(=O)[C@H](CC1=CC=CC=C1)N[C@@H](CC(C)C)C(=O)N2CCOCCOC3=CC=CC=C3OCCOCC2)NC(=O)[C@H](CC4=CC=C(C=C4)O)N.Cl
Structure:

CAS RN: 145594-19-0
CAS Name: (2S)-2-[[2-[[(2R)-2-[[(2S)-3-[4-[(2-methylpropan-2-yl)oxy-oxomethoxy]phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid
OPENEYE Name: (2S)-2-[[2-[[(2R)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-(4-tert-butoxycarbonyloxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoic acid
IUPAC Name: (2S)-2-[[2-[[(2R)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: (2S)-2-[2-[[(2R)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C33H44N4O10
MOLECULAR WEIGHT: 656.72326
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)OC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
Structure:

CAS RN: 145594-18-9
CAS Name: N-[6-oxo-6-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)hexyl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[6-oxo-6-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)hexyl]carbamate
IUPAC Name: tert-butyl N-[6-oxo-6-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)hexyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[6-oxidanylidene-6-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)hexyl]carbamate
MOLECULAR FORMULA: C25H40N2O7
MOLECULAR WEIGHT: 480.5943
SMILES: CC(C)(C)OC(=O)NCCCCCC(=O)N1CCOCCOC2=CC=CC=C2OCCOCC1
Structure:

CAS RN: 145594-17-8
CAS Name: N-[(2S)-4-methyl-1-oxo-1-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)pentan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[(1S)-3-methyl-1-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-triene-8-carbonyl)butyl]carbamate
IUPAC Name: tert-butyl N-[(2S)-4-methyl-1-oxo-1-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)pentan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2S)-4-methyl-1-oxidanylidene-1-(2,5,11,14-tetraoxa-8-azabicyclo[13.4.0]nonadeca-1(19),15,17-trien-8-yl)pentan-2-yl]carbamate
MOLECULAR FORMULA: C25H40N2O7
MOLECULAR WEIGHT: 480.5943
SMILES: CC(C)C[C@@H](C(=O)N1CCOCCOC2=CC=CC=C2OCCOCC1)NC(=O)OC(C)(C)C
Structure:

CAS RN: 145511-51-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H19ClN2
MOLECULAR WEIGHT: 262.77776
SMILES: CC1=CC2=C(C=C1)N3CCN[C@@H]4C3=C2CCC4.Cl
Structure:

CAS RN: 145511-50-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H19ClN2
MOLECULAR WEIGHT: 262.77776
SMILES: CC1=CC2=C(C=C1)N3CCN[C@H]4C3=C2CCC4.Cl
Structure:

CAS RN: 145510-85-6
CAS Name: 2-[2-(4-bromophenyl)-4-hydroxy-5-oxo-1-phenyl-2H-pyrrol-3-yl]acetic acid
OPENEYE Name: 2-[2-(4-bromophenyl)-4-hydroxy-5-oxo-1-phenyl-2H-pyrrol-3-yl]acetic acid
IUPAC Name: 2-[2-(4-bromophenyl)-4-hydroxy-5-oxo-1-phenyl-2H-pyrrol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[2-(4-bromophenyl)-4-oxidanyl-5-oxidanylidene-1-phenyl-2H-pyrrol-3-yl]ethanoic acid
MOLECULAR FORMULA: C18H14BrNO4
MOLECULAR WEIGHT: 388.21206
SMILES: C1=CC=C(C=C1)N2C(C(=C(C2=O)O)CC(=O)O)C3=CC=C(C=C3)Br
Structure:

CAS RN: 145488-32-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H10FNO4
MOLECULAR WEIGHT: 287.242603
SMILES: C1C2=C(C(C3=C(N2)COC3=O)C4=CC=CC=C4F)C(=O)O1
Structure:

CAS RN: 145441-35-6
CAS Name: 6-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)ammonio]hexanoate
OPENEYE Name: 6-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)ammonio]hexanoate
IUPAC Name: 6-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)azaniumyl]hexanoate
SYSTEMATIC NAME: 6-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecyl-dimethyl-azaniumyl]hexanoate
MOLECULAR FORMULA: C19H22F17NO2
MOLECULAR WEIGHT: 619.356334
SMILES: C[N+](C)(CCCCCC(=O)[O-])CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Structure:

CAS RN: 145441-34-5
CAS Name: 5-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)ammonio]pentanoate
OPENEYE Name: 5-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)ammonio]pentanoate
IUPAC Name: 5-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)azaniumyl]pentanoate
SYSTEMATIC NAME: 5-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecyl-dimethyl-azaniumyl]pentanoate
MOLECULAR FORMULA: C18H20F17NO2
MOLECULAR WEIGHT: 605.329754
SMILES: C[N+](C)(CCCCC(=O)[O-])CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Structure:

CAS RN: 145441-33-4
CAS Name: 4-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)ammonio]butanoate
OPENEYE Name: 4-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)ammonio]butanoate
IUPAC Name: 4-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)azaniumyl]butanoate
SYSTEMATIC NAME: 4-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecyl-dimethyl-azaniumyl]butanoate
MOLECULAR FORMULA: C17H18F17NO2
MOLECULAR WEIGHT: 591.303174
SMILES: C[N+](C)(CCCC(=O)[O-])CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Structure:

CAS RN: 145441-31-2
CAS Name: 2-[dimethyl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)ammonio]acetate
OPENEYE Name: 2-[dimethyl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)ammonio]acetate
IUPAC Name: 2-[dimethyl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)azaniumyl]acetate
SYSTEMATIC NAME: 2-[dimethyl-[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecakis(fluoranyl)octyl]azaniumyl]ethanoate
MOLECULAR FORMULA: C12H12F13NO2
MOLECULAR WEIGHT: 449.208422
SMILES: C[N+](C)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CC(=O)[O-]
Structure:

CAS RN: 145441-30-1
CAS Name: 2-[dimethyl(3,3,4,4,5,5,6,6,6-nonafluorohexyl)ammonio]acetate
OPENEYE Name: 2-[dimethyl(3,3,4,4,5,5,6,6,6-nonafluorohexyl)ammonio]acetate
IUPAC Name: 2-[dimethyl(3,3,4,4,5,5,6,6,6-nonafluorohexyl)azaniumyl]acetate
SYSTEMATIC NAME: 2-[dimethyl-[3,3,4,4,5,5,6,6,6-nonakis(fluoranyl)hexyl]azaniumyl]ethanoate
MOLECULAR FORMULA: C10H12F9NO2
MOLECULAR WEIGHT: 349.193409
SMILES: C[N+](C)(CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)CC(=O)[O-]
Structure:

CAS RN: 145441-15-2
CAS Name: 5-methyl-N-(2-pyrimidinyl)-3-isoxazolecarboxamide
OPENEYE Name: 5-methyl-N-pyrimidin-2-yl-isoxazole-3-carboxamide
IUPAC Name: 5-methyl-N-pyrimidin-2-yl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-methyl-N-pyrimidin-2-yl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C9H8N4O2
MOLECULAR WEIGHT: 204.18542
SMILES: CC1=CC(=NO1)C(=O)NC2=NC=CC=N2
Structure:

CAS RN: 145441-14-1
CAS Name: 5-methyl-N-(2,4,6-trimethyl-3-pyridinyl)-3-isoxazolecarboxamide
OPENEYE Name: 5-methyl-N-(2,4,6-trimethyl-3-pyridyl)isoxazole-3-carboxamide
IUPAC Name: 5-methyl-N-(2,4,6-trimethylpyridin-3-yl)-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: 5-methyl-N-(2,4,6-trimethylpyridin-3-yl)-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C13H15N3O2
MOLECULAR WEIGHT: 245.2771
SMILES: CC1=CC(=NC(=C1NC(=O)C2=NOC(=C2)C)C)C
Structure:

CAS RN: 145441-13-0
CAS Name: N-(3,5-dimethyl-4-pyridinyl)-5-methyl-3-isoxazolecarboxamide
OPENEYE Name: N-(3,5-dimethyl-4-pyridyl)-5-methyl-isoxazole-3-carboxamide
IUPAC Name: N-(3,5-dimethylpyridin-4-yl)-5-methyl-1,2-oxazole-3-carboxamide
SYSTEMATIC NAME: N-(3,5-dimethylpyridin-4-yl)-5-methyl-1,2-oxazole-3-carboxamide
MOLECULAR FORMULA: C12H13N3O2
MOLECULAR WEIGHT: 231.25052
SMILES: CC1=CC(=NO1)C(=O)NC2=C(C=NC=C2C)C
Structure:

CAS RN: 145441-12-9
CAS Name: 5-[(2,6-dimethylanilino)-oxomethyl]-3-isoxazolecarboxylic acid methyl ester
OPENEYE Name: methyl 5-[(2,6-dimethylphenyl)carbamoyl]isoxazole-3-carboxylate
IUPAC Name: methyl 5-[(2,6-dimethylphenyl)carbamoyl]-1,2-oxazole-3-carboxylate
SYSTEMATIC NAME: methyl 5-[(2,6-dimethylphenyl)carbamoyl]-1,2-oxazole-3-carboxylate
MOLECULAR FORMULA: C14H14N2O4
MOLECULAR WEIGHT: 274.27196
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=NO2)C(=O)OC
Structure:

CAS RN: 145441-11-8
CAS Name: 3-methyl-N-(2,4,6-trimethylphenyl)-5-isoxazolecarboxamide
OPENEYE Name: 3-methyl-N-(2,4,6-trimethylphenyl)isoxazole-5-carboxamide
IUPAC Name: 3-methyl-N-(2,4,6-trimethylphenyl)-1,2-oxazole-5-carboxamide
SYSTEMATIC NAME: 3-methyl-N-(2,4,6-trimethylphenyl)-1,2-oxazole-5-carboxamide
MOLECULAR FORMULA: C14H16N2O2
MOLECULAR WEIGHT: 244.28904
SMILES: CC1=CC(=C(C(=C1)C)NC(=O)C2=CC(=NO2)C)C
Structure:

CAS RN: 145441-10-7
CAS Name: N-(2,6-dimethylphenyl)-3-(hydroxymethyl)-5-isoxazolecarboxamide
OPENEYE Name: N-(2,6-dimethylphenyl)-3-(hydroxymethyl)isoxazole-5-carboxamide
IUPAC Name: N-(2,6-dimethylphenyl)-3-(hydroxymethyl)-1,2-oxazole-5-carboxamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-3-(hydroxymethyl)-1,2-oxazole-5-carboxamide
MOLECULAR FORMULA: C13H14N2O3
MOLECULAR WEIGHT: 246.26186
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=NO2)CO
Structure: