CAS RN: 6629-49-8
CAS Name: 1-diethoxyphosphoryl-2-phenylhydrazine
OPENEYE Name: 1-diethoxyphosphoryl-2-phenyl-hydrazine
IUPAC Name: 1-diethoxyphosphoryl-2-phenylhydrazine
SYSTEMATIC NAME: 1-diethoxyphosphoryl-2-phenyl-diazane
MOLECULAR FORMULA: C10H17N2O3P
MOLECULAR WEIGHT: 244.227341
SMILES: CCOP(=O)(NNC1=CC=CC=C1)OCC
Structure:
CAS RN: 6629-36-3
CAS Name: N-(benzenesulfonyl)-N-(phenylmethyl)carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-(benzenesulfonyl)-N-benzyl-carbamate
IUPAC Name: benzyl N-(benzenesulfonyl)-N-benzylcarbamate
SYSTEMATIC NAME: (phenylmethyl) N-(phenylmethyl)-N-(phenylsulfonyl)carbamate
MOLECULAR FORMULA: C21H19NO4S
MOLECULAR WEIGHT: 381.44486
SMILES: C1=CC=C(C=C1)CN(C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3
Structure:
CAS RN: 6629-33-0
CAS Name: 2-propyl-3,1-benzoxathiin-4-one
OPENEYE Name: 2-propyl-3,1-benzoxathiin-4-one
IUPAC Name: 2-propyl-3,1-benzoxathiin-4-one
SYSTEMATIC NAME: 2-propyl-3,1-benzoxathiin-4-one
MOLECULAR FORMULA: C11H12O2S
MOLECULAR WEIGHT: 208.27678
SMILES: CCCC1OC(=O)C2=CC=CC=C2S1
Structure:
CAS RN: 5651-33-2
CAS Name: 3,1-benzoxathiin-4-one
OPENEYE Name: 3,1-benzoxathiin-4-one
IUPAC Name: 3,1-benzoxathiin-4-one
SYSTEMATIC NAME: 3,1-benzoxathiin-4-one
MOLECULAR FORMULA: C8H6O2S
MOLECULAR WEIGHT: 166.19704
SMILES: C1OC(=O)C2=CC=CC=C2S1
Structure:
CAS RN: 5452-30-2
CAS Name: 1-(6-chloro-1H-indol-3-yl)-N,N-dimethylmethanamine
OPENEYE Name: 1-(6-chloro-1H-indol-3-yl)-N,N-dimethyl-methanamine
IUPAC Name: 1-(6-chloro-1H-indol-3-yl)-N,N-dimethylmethanamine
SYSTEMATIC NAME: 1-(6-chloranyl-1H-indol-3-yl)-N,N-dimethyl-methanamine
MOLECULAR FORMULA: C11H13ClN2
MOLECULAR WEIGHT: 208.68732
SMILES: CN(C)CC1=CNC2=C1C=CC(=C2)Cl
Structure:
CAS RN: 51833-36-4
CAS Name: 2-(2,4-dichlorophenoxy)acetonitrile
OPENEYE Name: 2-(2,4-dichlorophenoxy)acetonitrile
IUPAC Name: 2-(2,4-dichlorophenoxy)acetonitrile
SYSTEMATIC NAME: 2-[2,4-bis(chloranyl)phenoxy]ethanenitrile
MOLECULAR FORMULA: C8H5Cl2NO
MOLECULAR WEIGHT: 202.0374
SMILES: C1=CC(=C(C=C1Cl)Cl)OCC#N
Structure:
CAS RN: 23361-67-3
CAS Name: 1-(1-azepanyl)-3-methyl-1-butanone
OPENEYE Name: 1-(azepan-1-yl)-3-methyl-butan-1-one
IUPAC Name: 1-(azepan-1-yl)-3-methylbutan-1-one
SYSTEMATIC NAME: 1-(azepan-1-yl)-3-methyl-butan-1-one
MOLECULAR FORMULA: C11H21NO
MOLECULAR WEIGHT: 183.29054
SMILES: CC(C)CC(=O)N1CCCCCC1
Structure:
CAS RN: 7496-99-3
CAS Name: 4-aminobenzoic acid [1-[(dimethylamino)methyl]-2-naphthalenyl] ester
OPENEYE Name: [1-[(dimethylamino)methyl]-2-naphthyl] 4-aminobenzoate
IUPAC Name: [1-[(dimethylamino)methyl]naphthalen-2-yl] 4-aminobenzoate
SYSTEMATIC NAME: [1-[(dimethylamino)methyl]naphthalen-2-yl] 4-azanylbenzoate
MOLECULAR FORMULA: C20H20N2O2
MOLECULAR WEIGHT: 320.385
SMILES: CN(C)CC1=C(C=CC2=CC=CC=C21)OC(=O)C3=CC=C(C=C3)N
Structure:
CAS RN: 107167-30-6
CAS Name: 4-aminobenzoic acid [1,1,1-trifluoro-4-(1-piperidinyl)butan-2-yl] ester
OPENEYE Name: [3-(1-piperidyl)-1-(trifluoromethyl)propyl] 4-aminobenzoate
IUPAC Name: (1,1,1-trifluoro-4-piperidin-1-ylbutan-2-yl) 4-aminobenzoate
SYSTEMATIC NAME: [1,1,1-tris(fluoranyl)-4-piperidin-1-yl-butan-2-yl] 4-azanylbenzoate
MOLECULAR FORMULA: C16H21F3N2O2
MOLECULAR WEIGHT: 330.34535
SMILES: C1CCN(CC1)CCC(C(F)(F)F)OC(=O)C2=CC=C(C=C2)N
Structure:
CAS RN: 105455-76-3
CAS Name: 1-[[(2,4,6-trimethylphenyl)thio]methyl]piperidine
OPENEYE Name: 1-[(2,4,6-trimethylphenyl)sulfanylmethyl]piperidine
IUPAC Name: 1-[(2,4,6-trimethylphenyl)sulfanylmethyl]piperidine
SYSTEMATIC NAME: 1-[(2,4,6-trimethylphenyl)sulfanylmethyl]piperidine
MOLECULAR FORMULA: C15H23NS
MOLECULAR WEIGHT: 249.41482
SMILES: CC1=CC(=C(C(=C1)C)SCN2CCCCC2)C
Structure:
CAS RN: 10544-02-2
CAS Name: 2,5-diphenyl-1H-pyrazol-3-one
OPENEYE Name: 2,5-diphenyl-1H-pyrazol-3-one
IUPAC Name: 2,5-diphenyl-1H-pyrazol-3-one
SYSTEMATIC NAME: 2,5-diphenyl-1H-pyrazol-3-one
MOLECULAR FORMULA: C15H12N2O
MOLECULAR WEIGHT: 236.26858
SMILES: C1=CC=C(C=C1)C2=CC(=O)N(N2)C3=CC=CC=C3
Structure:
CAS RN: 1020-40-2
CAS Name: N-(2-mercaptophenyl)benzamide
OPENEYE Name: N-(2-sulfanylphenyl)benzamide
IUPAC Name: N-(2-sulfanylphenyl)benzamide
SYSTEMATIC NAME: N-(2-sulfanylphenyl)benzamide
MOLECULAR FORMULA: C13H11NOS
MOLECULAR WEIGHT: 229.29754
SMILES: C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2S
Structure:
CAS RN: 16880-75-4
CAS Name: 1,1,1-trifluoro-4-(4-morpholinyl)-3-(4-morpholinylmethyl)butane-2,2-diol
OPENEYE Name: 1,1,1-trifluoro-4-morpholino-3-(morpholinomethyl)butane-2,2-diol
IUPAC Name: 1,1,1-trifluoro-4-morpholin-4-yl-3-(morpholin-4-ylmethyl)butane-2,2-diol
SYSTEMATIC NAME: 1,1,1-tris(fluoranyl)-4-morpholin-4-yl-3-(morpholin-4-ylmethyl)butane-2,2-diol
MOLECULAR FORMULA: C13H23F3N2O4
MOLECULAR WEIGHT: 328.32793
SMILES: C1COCCN1CC(CN2CCOCC2)C(C(F)(F)F)(O)O
Structure:
CAS RN: 6631-90-9
CAS Name: 2-[(cyclohexylamino)methyl]-4-mercaptophenol
OPENEYE Name: 2-[(cyclohexylamino)methyl]-4-sulfanyl-phenol
IUPAC Name: 2-[(cyclohexylamino)methyl]-4-sulfanylphenol
SYSTEMATIC NAME: 2-[(cyclohexylamino)methyl]-4-sulfanyl-phenol
MOLECULAR FORMULA: C13H19NOS
MOLECULAR WEIGHT: 237.36106
SMILES: C1CCC(CC1)NCC2=C(C=CC(=C2)S)O
Structure:
CAS RN: 7526-28-5
CAS Name: 1-[(phenylthio)methyl]piperidine
OPENEYE Name: 1-(phenylsulfanylmethyl)piperidine
IUPAC Name: 1-(phenylsulfanylmethyl)piperidine
SYSTEMATIC NAME: 1-(phenylsulfanylmethyl)piperidine
MOLECULAR FORMULA: C12H17NS
MOLECULAR WEIGHT: 207.33508
SMILES: C1CCN(CC1)CSC2=CC=CC=C2
Structure:
CAS RN: 75218-27-8
CAS Name: 1-[[(4-nitrophenyl)thio]methyl]piperidine
OPENEYE Name: 1-[(4-nitrophenyl)sulfanylmethyl]piperidine
IUPAC Name: 1-[(4-nitrophenyl)sulfanylmethyl]piperidine
SYSTEMATIC NAME: 1-[(4-nitrophenyl)sulfanylmethyl]piperidine
MOLECULAR FORMULA: C12H16N2O2S
MOLECULAR WEIGHT: 252.33264
SMILES: C1CCN(CC1)CSC2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 75217-62-8
CAS Name: 1-[[(4-bromophenyl)thio]methyl]piperidine
OPENEYE Name: 1-[(4-bromophenyl)sulfanylmethyl]piperidine
IUPAC Name: 1-[(4-bromophenyl)sulfanylmethyl]piperidine
SYSTEMATIC NAME: 1-[(4-bromophenyl)sulfanylmethyl]piperidine
MOLECULAR FORMULA: C12H16BrNS
MOLECULAR WEIGHT: 286.23114
SMILES: C1CCN(CC1)CSC2=CC=C(C=C2)Br
Structure:
CAS RN: 5410-90-2
CAS Name: 2-[2-(carboxymethoxy)phenyl]acetic acid
OPENEYE Name: 2-[2-(carboxymethoxy)phenyl]acetic acid
IUPAC Name: 2-[2-(carboxymethoxy)phenyl]acetic acid
SYSTEMATIC NAME: 2-[2-(2-hydroxy-2-oxoethyloxy)phenyl]ethanoic acid
MOLECULAR FORMULA: C10H10O5
MOLECULAR WEIGHT: 210.1834
SMILES: C1=CC=C(C(=C1)CC(=O)O)OCC(=O)O
Structure:
CAS RN: 7303-80-2
CAS Name: N-(4-amino-1-methyl-6-oxo-5-pyrimidinyl)formamide
OPENEYE Name: N-(4-amino-1-methyl-6-oxo-pyrimidin-5-yl)formamide
IUPAC Name: N-(4-amino-1-methyl-6-oxopyrimidin-5-yl)formamide
SYSTEMATIC NAME: N-(4-azanyl-1-methyl-6-oxidanylidene-pyrimidin-5-yl)methanamide
MOLECULAR FORMULA: C6H8N4O2
MOLECULAR WEIGHT: 168.15332
SMILES: CN1C=NC(=C(C1=O)NC=O)N
Structure:
CAS RN: 73038-05-8
CAS Name: N-[4-amino-1-methyl-2-(methylthio)-6-oxo-5-pyrimidinyl]formamide
OPENEYE Name: N-(4-amino-1-methyl-2-methylsulfanyl-6-oxo-pyrimidin-5-yl)formamide
IUPAC Name: N-(4-amino-1-methyl-2-methylsulfanyl-6-oxopyrimidin-5-yl)formamide
SYSTEMATIC NAME: N-(4-azanyl-1-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidin-5-yl)methanamide
MOLECULAR FORMULA: C7H10N4O2S
MOLECULAR WEIGHT: 214.2449
SMILES: CN1C(=O)C(=C(N=C1SC)N)NC=O
Structure:
CAS RN: 80081-45-4
CAS Name: 2,3-dihydroxybutanedihydrazide
OPENEYE Name: 2,3-dihydroxybutanedihydrazide
IUPAC Name: 2,3-dihydroxybutanedihydrazide
SYSTEMATIC NAME: 2,3-bis(oxidanyl)butanedihydrazide
MOLECULAR FORMULA: C4H10N4O4
MOLECULAR WEIGHT: 178.1466
SMILES: C(C(C(=O)NN)O)(C(=O)NN)O
Structure:
CAS RN: 98094-77-0
CAS Name: 2-aminoethanol; 2-[(2-hydroxyphenyl)methylidene]propanedioic acid
OPENEYE Name: 2-aminoethanol; 2-[(2-hydroxyphenyl)methylene]propanedioic acid
IUPAC Name: 2-aminoethanol; 2-[(2-hydroxyphenyl)methylidene]propanedioic acid
SYSTEMATIC NAME: 2-azanylethanol; 2-[(2-hydroxyphenyl)methylidene]propanedioic acid
MOLECULAR FORMULA: C12H15NO6
MOLECULAR WEIGHT: 269.2506
SMILES: C1=CC=C(C(=C1)C=C(C(=O)O)C(=O)O)O.C(CO)N
Structure:
CAS RN: 128969-88-0
CAS Name: 1-[hydroxy(phenyl)methyl]-1-cyclohexanol
OPENEYE Name: 1-[hydroxy(phenyl)methyl]cyclohexanol
IUPAC Name: 1-[hydroxy(phenyl)methyl]cyclohexan-1-ol
SYSTEMATIC NAME: 1-[oxidanyl(phenyl)methyl]cyclohexan-1-ol
MOLECULAR FORMULA: C13H18O2
MOLECULAR WEIGHT: 206.28082
SMILES: C1CCC(CC1)(C(C2=CC=CC=C2)O)O
Structure:
CAS RN: 5409-98-3
CAS Name: 1-[hydroxy(phenyl)methyl]-1-cyclopentanol
OPENEYE Name: 1-[hydroxy(phenyl)methyl]cyclopentanol
IUPAC Name: 1-[hydroxy(phenyl)methyl]cyclopentan-1-ol
SYSTEMATIC NAME: 1-[oxidanyl(phenyl)methyl]cyclopentan-1-ol
MOLECULAR FORMULA: C12H16O2
MOLECULAR WEIGHT: 192.25424
SMILES: C1CCC(C1)(C(C2=CC=CC=C2)O)O
Structure:
No comments:
Post a Comment