Friday, July 27, 2012

http://ChemLookup.com Compounds




CAS RN: 13151-92-3
CAS Name: 2-(4-methylpentan-2-ylidene)propanedinitrile
OPENEYE Name: 2-(1,3-dimethylbutylidene)propanedinitrile
IUPAC Name: 2-(4-methylpentan-2-ylidene)propanedinitrile
SYSTEMATIC NAME: 2-(4-methylpentan-2-ylidene)propanedinitrile
MOLECULAR FORMULA: C9H12N2
MOLECULAR WEIGHT: 148.20498
SMILES: CC(C)CC(=C(C#N)C#N)C
Structure:

CAS RN: 7687-09-4
CAS Name: 3,4-dihydro-2H-benzo[h]thiochromene
OPENEYE Name: 3,4-dihydro-2H-benzo[h]thiochromene
IUPAC Name: 3,4-dihydro-2H-benzo[h]thiochromene
SYSTEMATIC NAME: 3,4-dihydro-2H-benzo[h]thiochromene
MOLECULAR FORMULA: C13H12S
MOLECULAR WEIGHT: 200.29938
SMILES: C1CC2=C(C3=CC=CC=C3C=C2)SC1
Structure:

CAS RN: 84222-47-9
CAS Name: 1-(3-chlorophenyl)-3-(1-piperidinyl)-1-propanone
OPENEYE Name: 1-(3-chlorophenyl)-3-(1-piperidyl)propan-1-one
IUPAC Name: 1-(3-chlorophenyl)-3-piperidin-1-ylpropan-1-one
SYSTEMATIC NAME: 1-(3-chlorophenyl)-3-piperidin-1-yl-propan-1-one
MOLECULAR FORMULA: C14H18ClNO
MOLECULAR WEIGHT: 251.75182
SMILES: C1CCN(CC1)CCC(=O)C2=CC(=CC=C2)Cl
Structure:

CAS RN: 24005-61-6
CAS Name: 2-acetamido-2-(1-benzothiophen-3-ylmethyl)propanedioic acid diethyl ester
OPENEYE Name: diethyl 2-acetamido-2-(benzothiophen-3-ylmethyl)propanedioate
IUPAC Name: diethyl 2-acetamido-2-(1-benzothiophen-3-ylmethyl)propanedioate
SYSTEMATIC NAME: diethyl 2-acetamido-2-(1-benzothiophen-3-ylmethyl)propanedioate
MOLECULAR FORMULA: C18H21NO5S
MOLECULAR WEIGHT: 363.42804
SMILES: CCOC(=O)C(CC1=CSC2=CC=CC=C21)(C(=O)OCC)NC(=O)C
Structure:

CAS RN: 151221-98-6
CAS Name: 1-[(4-tert-butylphenyl)thio]-2-propanone
OPENEYE Name: 1-(4-tert-butylphenyl)sulfanylpropan-2-one
IUPAC Name: 1-(4-tert-butylphenyl)sulfanylpropan-2-one
SYSTEMATIC NAME: 1-(4-tert-butylphenyl)sulfanylpropan-2-one
MOLECULAR FORMULA: C13H18OS
MOLECULAR WEIGHT: 222.34642
SMILES: CC(=O)CSC1=CC=C(C=C1)C(C)(C)C
Structure:

CAS RN: 3216-49-7
CAS Name: 3-methyl-1-benzothiophene-2-carbonitrile
OPENEYE Name: 3-methylbenzothiophene-2-carbonitrile
IUPAC Name: 3-methyl-1-benzothiophene-2-carbonitrile
SYSTEMATIC NAME: 3-methyl-1-benzothiophene-2-carbonitrile
MOLECULAR FORMULA: C10H7NS
MOLECULAR WEIGHT: 173.23428
SMILES: CC1=C(SC2=CC=CC=C12)C#N
Structure:

CAS RN: 5400-95-3
CAS Name: 2-(1-benzothiophen-3-ylmethylidene)propanedinitrile
OPENEYE Name: 2-(benzothiophen-3-ylmethylene)propanedinitrile
IUPAC Name: 2-(1-benzothiophen-3-ylmethylidene)propanedinitrile
SYSTEMATIC NAME: 2-(1-benzothiophen-3-ylmethylidene)propanedinitrile
MOLECULAR FORMULA: C12H6N2S
MOLECULAR WEIGHT: 210.25444
SMILES: C1=CC=C2C(=C1)C(=CS2)C=C(C#N)C#N
Structure:

CAS RN: 28858-05-1
CAS Name: 5-phenyl-1,5-dihydroindeno[1,2-d]pyrimidin-4-one
OPENEYE Name: 5-phenyl-1,5-dihydroindeno[1,2-d]pyrimidin-4-one
IUPAC Name: 5-phenyl-1,5-dihydroindeno[1,2-d]pyrimidin-4-one
SYSTEMATIC NAME: 5-phenyl-1,5-dihydroindeno[1,2-d]pyrimidin-4-one
MOLECULAR FORMULA: C17H12N2O
MOLECULAR WEIGHT: 260.28998
SMILES: C1=CC=C(C=C1)C2C3=CC=CC=C3C4=C2C(=O)N=CN4
Structure:

CAS RN: 28858-08-4
CAS Name: N',N'-diethyl-N-(5-phenyl-5H-indeno[1,2-d]pyrimidin-4-yl)propane-1,3-diamine
OPENEYE Name: N',N'-diethyl-N-(5-phenyl-5H-indeno[1,2-d]pyrimidin-4-yl)propane-1,3-diamine
IUPAC Name: N',N'-diethyl-N-(5-phenyl-5H-indeno[1,2-d]pyrimidin-4-yl)propane-1,3-diamine
SYSTEMATIC NAME: N',N'-diethyl-N-(5-phenyl-5H-indeno[1,2-d]pyrimidin-4-yl)propane-1,3-diamine
MOLECULAR FORMULA: C24H28N4
MOLECULAR WEIGHT: 372.50592
SMILES: CCN(CC)CCCNC1=NC=NC2=C1C(C3=CC=CC=C32)C4=CC=CC=C4
Structure:

CAS RN: 31242-12-3
CAS Name: 1-[1-aziridinyl-[6-[bis(1-aziridinyl)phosphoryl]hexyl]phosphoryl]aziridine
OPENEYE Name: 1-[aziridin-1-yl-[6-[bis(aziridin-1-yl)phosphoryl]hexyl]phosphoryl]aziridine
IUPAC Name: 1-[aziridin-1-yl-[6-[bis(aziridin-1-yl)phosphoryl]hexyl]phosphoryl]aziridine
SYSTEMATIC NAME: 1-[aziridin-1-yl-[6-[bis(aziridin-1-yl)phosphoryl]hexyl]phosphoryl]aziridine
MOLECULAR FORMULA: C14H28N4O2P2
MOLECULAR WEIGHT: 346.345242
SMILES: C1CN1P(=O)(CCCCCCP(=O)(N2CC2)N3CC3)N4CC4
Structure:

CAS RN: 17752-78-2
CAS Name: N-(4-methylphenyl)carbamic acid 2-[3-methyl-N-[2-[(4-methylanilino)-oxomethoxy]ethyl]anilino]ethyl ester
OPENEYE Name: 2-[3-methyl-N-[2-(p-tolylcarbamoyloxy)ethyl]anilino]ethyl N-(p-tolyl)carbamate
IUPAC Name: 2-[3-methyl-N-[2-[(4-methylphenyl)carbamoyloxy]ethyl]anilino]ethyl N-(4-methylphenyl)carbamate
SYSTEMATIC NAME: 2-[(3-methylphenyl)-[2-[(4-methylphenyl)carbamoyloxy]ethyl]amino]ethyl N-(4-methylphenyl)carbamate
MOLECULAR FORMULA: C27H31N3O4
MOLECULAR WEIGHT: 461.55274
SMILES: CC1=CC=C(C=C1)NC(=O)OCCN(CCOC(=O)NC2=CC=C(C=C2)C)C3=CC=CC(=C3)C
Structure:

CAS RN: 17753-02-5
CAS Name: N-(3-methylphenyl)carbamic acid 2-[3-methyl-N-[2-[(3-methylanilino)-oxomethoxy]ethyl]anilino]ethyl ester
OPENEYE Name: 2-[3-methyl-N-[2-(m-tolylcarbamoyloxy)ethyl]anilino]ethyl N-(m-tolyl)carbamate
IUPAC Name: 2-[3-methyl-N-[2-[(3-methylphenyl)carbamoyloxy]ethyl]anilino]ethyl N-(3-methylphenyl)carbamate
SYSTEMATIC NAME: 2-[(3-methylphenyl)-[2-[(3-methylphenyl)carbamoyloxy]ethyl]amino]ethyl N-(3-methylphenyl)carbamate
MOLECULAR FORMULA: C27H31N3O4
MOLECULAR WEIGHT: 461.55274
SMILES: CC1=CC(=CC=C1)NC(=O)OCCN(CCOC(=O)NC2=CC=CC(=C2)C)C3=CC=CC(=C3)C
Structure:

CAS RN: 1774-97-6
CAS Name: N-(3-chlorophenyl)carbamic acid 2-[2-[(3-chloroanilino)-oxomethoxy]ethyl-(phenylmethyl)amino]ethyl ester
OPENEYE Name: 2-[benzyl-[2-[(3-chlorophenyl)carbamoyloxy]ethyl]amino]ethyl N-(3-chlorophenyl)carbamate
IUPAC Name: 2-[benzyl-[2-[(3-chlorophenyl)carbamoyloxy]ethyl]amino]ethyl N-(3-chlorophenyl)carbamate
SYSTEMATIC NAME: 2-[2-[(3-chlorophenyl)carbamoyloxy]ethyl-(phenylmethyl)amino]ethyl N-(3-chlorophenyl)carbamate
MOLECULAR FORMULA: C25H25Cl2N3O4
MOLECULAR WEIGHT: 502.3897
SMILES: C1=CC=C(C=C1)CN(CCOC(=O)NC2=CC(=CC=C2)Cl)CCOC(=O)NC3=CC(=CC=C3)Cl
Structure:

CAS RN: 1774-96-5
CAS Name: N-(4-chlorophenyl)carbamic acid 2-[2-[(4-chloroanilino)-oxomethoxy]ethyl-(phenylmethyl)amino]ethyl ester
OPENEYE Name: 2-[benzyl-[2-[(4-chlorophenyl)carbamoyloxy]ethyl]amino]ethyl N-(4-chlorophenyl)carbamate
IUPAC Name: 2-[benzyl-[2-[(4-chlorophenyl)carbamoyloxy]ethyl]amino]ethyl N-(4-chlorophenyl)carbamate
SYSTEMATIC NAME: 2-[2-[(4-chlorophenyl)carbamoyloxy]ethyl-(phenylmethyl)amino]ethyl N-(4-chlorophenyl)carbamate
MOLECULAR FORMULA: C25H25Cl2N3O4
MOLECULAR WEIGHT: 502.3897
SMILES: C1=CC=C(C=C1)CN(CCOC(=O)NC2=CC=C(C=C2)Cl)CCOC(=O)NC3=CC=C(C=C3)Cl
Structure:

CAS RN: 148485-16-9
CAS Name: tris(2,2-dimethyl-1-aziridinyl)-sulfanylidenephosphorane
OPENEYE Name: tris(2,2-dimethylaziridin-1-yl)-thioxo-$l^{5}-phosphane
IUPAC Name: tris(2,2-dimethylaziridin-1-yl)-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: tris(2,2-dimethylaziridin-1-yl)-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C12H24N3PS
MOLECULAR WEIGHT: 273.377821
SMILES: CC1(CN1P(=S)(N2CC2(C)C)N3CC3(C)C)C
Structure:

CAS RN: 38094-35-8
CAS Name: N-(2-amino-1-cyano-2-oxoethyl)methanimidic acid ethyl ester
OPENEYE Name: ethyl N-(2-amino-1-cyano-2-oxo-ethyl)methanimidate
IUPAC Name: ethyl N-(2-amino-1-cyano-2-oxoethyl)methanimidate
SYSTEMATIC NAME: ethyl N-(2-azanyl-1-cyano-2-oxidanylidene-ethyl)methanimidate
MOLECULAR FORMULA: C6H9N3O2
MOLECULAR WEIGHT: 155.15456
SMILES: CCOC=NC(C#N)C(=O)N
Structure:

CAS RN: 59722-33-7
CAS Name: 3-[(2-methylphenyl)thio]propanoic acid
OPENEYE Name: 3-(o-tolylsulfanyl)propanoic acid
IUPAC Name: 3-(2-methylphenyl)sulfanylpropanoic acid
SYSTEMATIC NAME: 3-(2-methylphenyl)sulfanylpropanoic acid
MOLECULAR FORMULA: C10H12O2S
MOLECULAR WEIGHT: 196.26608
SMILES: CC1=CC=CC=C1SCCC(=O)O
Structure:

CAS RN: 3133-79-7
CAS Name: 3-methyl-1-benzothiophene-2-carboxamide
OPENEYE Name: 3-methylbenzothiophene-2-carboxamide
IUPAC Name: 3-methyl-1-benzothiophene-2-carboxamide
SYSTEMATIC NAME: 3-methyl-1-benzothiophene-2-carboxamide
MOLECULAR FORMULA: C10H9NOS
MOLECULAR WEIGHT: 191.24956
SMILES: CC1=C(SC2=CC=CC=C12)C(=O)N
Structure:

CAS RN: 5381-23-7
CAS Name: 2-bromo-3-methyl-1-benzothiophene
OPENEYE Name: 2-bromo-3-methyl-benzothiophene
IUPAC Name: 2-bromo-3-methyl-1-benzothiophene
SYSTEMATIC NAME: 2-bromanyl-3-methyl-1-benzothiophene
MOLECULAR FORMULA: C9H7BrS
MOLECULAR WEIGHT: 227.12088
SMILES: CC1=C(SC2=CC=CC=C12)Br
Structure:

CAS RN: 1977-05-5
CAS Name: 2-(2-methyl-3-pyridinyl)ethanol
OPENEYE Name: 2-(2-methyl-3-pyridyl)ethanol
IUPAC Name: 2-(2-methylpyridin-3-yl)ethanol
SYSTEMATIC NAME: 2-(2-methylpyridin-3-yl)ethanol
MOLECULAR FORMULA: C8H11NO
MOLECULAR WEIGHT: 137.17904
SMILES: CC1=C(C=CC=N1)CCO
Structure:

CAS RN: 31542-62-8
CAS Name: 2-(8-methyl-2,3-dihydro-1-benzothiopyran-4-ylidene)propanedinitrile
OPENEYE Name: 2-(8-methylthiochroman-4-ylidene)propanedinitrile
IUPAC Name: 2-(8-methyl-2,3-dihydrothiochromen-4-ylidene)propanedinitrile
SYSTEMATIC NAME: 2-(8-methyl-2,3-dihydrothiochromen-4-ylidene)propanedinitrile
MOLECULAR FORMULA: C13H10N2S
MOLECULAR WEIGHT: 226.2969
SMILES: CC1=CC=CC2=C1SCCC2=C(C#N)C#N
Structure:

CAS RN: 30429-79-9
CAS Name: 2-(6-methyl-2,3-dihydro-1-benzothiopyran-4-ylidene)propanedinitrile
OPENEYE Name: 2-(6-methylthiochroman-4-ylidene)propanedinitrile
IUPAC Name: 2-(6-methyl-2,3-dihydrothiochromen-4-ylidene)propanedinitrile
SYSTEMATIC NAME: 2-(6-methyl-2,3-dihydrothiochromen-4-ylidene)propanedinitrile
MOLECULAR FORMULA: C13H10N2S
MOLECULAR WEIGHT: 226.2969
SMILES: CC1=CC2=C(C=C1)SCCC2=C(C#N)C#N
Structure:

CAS RN: 30430-68-3
CAS Name: 2-(6-methyl-2,3-dihydro-1H-quinolin-4-ylidene)propanedinitrile
OPENEYE Name: 2-(6-methyl-2,3-dihydro-1H-quinolin-4-ylidene)propanedinitrile
IUPAC Name: 2-(6-methyl-2,3-dihydro-1H-quinolin-4-ylidene)propanedinitrile
SYSTEMATIC NAME: 2-(6-methyl-2,3-dihydro-1H-quinolin-4-ylidene)propanedinitrile
MOLECULAR FORMULA: C13H11N3
MOLECULAR WEIGHT: 209.24654
SMILES: CC1=CC2=C(C=C1)NCCC2=C(C#N)C#N
Structure:

CAS RN: 94627-91-5
CAS Name: 1,3-bis[(4-methoxyphenyl)methyl]urea
OPENEYE Name: 1,3-bis[(4-methoxyphenyl)methyl]urea
IUPAC Name: 1,3-bis[(4-methoxyphenyl)methyl]urea
SYSTEMATIC NAME: 1,3-bis[(4-methoxyphenyl)methyl]urea
MOLECULAR FORMULA: C17H20N2O3
MOLECULAR WEIGHT: 300.3523
SMILES: COC1=CC=C(C=C1)CNC(=O)NCC2=CC=C(C=C2)OC
Structure:

CAS RN: 72520-37-7
CAS Name: 3-[[(4-chlorophenyl)thio]methyl]-4-hydroxynaphthalene-1,2-dione
OPENEYE Name: 3-[(4-chlorophenyl)sulfanylmethyl]-4-hydroxy-naphthalene-1,2-dione
IUPAC Name: 3-[(4-chlorophenyl)sulfanylmethyl]-4-hydroxynaphthalene-1,2-dione
SYSTEMATIC NAME: 3-[(4-chlorophenyl)sulfanylmethyl]-4-oxidanyl-naphthalene-1,2-dione
MOLECULAR FORMULA: C17H11ClO3S
MOLECULAR WEIGHT: 330.78544
SMILES: C1=CC=C2C(=C1)C(=C(C(=O)C2=O)CSC3=CC=C(C=C3)Cl)O
Structure:

CAS RN: 73175-11-8
CAS Name: 3-[[(4-chlorophenyl)thio]methyl]-4-hydroxynaphthalene-1,2-dione
OPENEYE Name: 3-[(4-chlorophenyl)sulfanylmethyl]-4-hydroxy-naphthalene-1,2-dione
IUPAC Name: 3-[(4-chlorophenyl)sulfanylmethyl]-4-hydroxynaphthalene-1,2-dione
SYSTEMATIC NAME: 3-[(4-chlorophenyl)sulfanylmethyl]-4-oxidanyl-naphthalene-1,2-dione
MOLECULAR FORMULA: C17H11ClO3S
MOLECULAR WEIGHT: 330.78544
SMILES: C1=CC=C2C(=C1)C(=C(C(=O)C2=O)CSC3=CC=C(C=C3)Cl)O
Structure:

CAS RN: 3065-27-8
CAS Name: 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid (2,4,5-trichlorophenyl) ester
OPENEYE Name: (2,4,5-trichlorophenyl) 2-(benzyloxycarbonylamino)-3-phenyl-propanoate
IUPAC Name: (2,4,5-trichlorophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
SYSTEMATIC NAME: [2,4,5-tris(chloranyl)phenyl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
MOLECULAR FORMULA: C23H18Cl3NO4
MOLECULAR WEIGHT: 478.75232
SMILES: C1=CC=C(C=C1)CC(C(=O)OC2=CC(=C(C=C2Cl)Cl)Cl)NC(=O)OCC3=CC=CC=C3
Structure:

CAS RN: 8024-27-9
CAS Name: 1-[4-(4-morpholinyl)phenyl]-1-propanone
OPENEYE Name: 1-(4-morpholinophenyl)propan-1-one
IUPAC Name: 1-(4-morpholin-4-ylphenyl)propan-1-one
SYSTEMATIC NAME: 1-(4-morpholin-4-ylphenyl)propan-1-one
MOLECULAR FORMULA: C13H17NO2
MOLECULAR WEIGHT: 219.27958
SMILES: CCC(=O)C1=CC=C(C=C1)N2CCOCC2
Structure:

CAS RN: 13139-15-6
CAS Name: 4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid
OPENEYE Name: 2-(tert-butoxycarbonylamino)-4-methyl-pentanoic acid
IUPAC Name: 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
SYSTEMATIC NAME: 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
MOLECULAR FORMULA: C11H21NO4
MOLECULAR WEIGHT: 231.28874
SMILES: CC(C)CC(C(=O)O)NC(=O)OC(C)(C)C
Structure:

CAS RN: 92575-67-2
CAS Name: 1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid
OPENEYE Name: 1-tert-butoxycarbonylpyrrolidine-2-carboxylic acid
IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: 1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C10H17NO4
MOLECULAR WEIGHT: 215.24628
SMILES: CC(C)(C)OC(=O)N1CCCC1C(=O)O
Structure:

CAS RN: 15761-39-4
CAS Name: 1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid
OPENEYE Name: 1-tert-butoxycarbonylpyrrolidine-2-carboxylic acid
IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: 1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C10H17NO4
MOLECULAR WEIGHT: 215.24628
SMILES: CC(C)(C)OC(=O)N1CCCC1C(=O)O
Structure:

CAS RN: 59433-50-0
CAS Name: 1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid
OPENEYE Name: 1-tert-butoxycarbonylpyrrolidine-2-carboxylic acid
IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: 1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C10H17NO4
MOLECULAR WEIGHT: 215.24628
SMILES: CC(C)(C)OC(=O)N1CCCC1C(=O)O
Structure:

CAS RN: 3744-87-4
CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid
OPENEYE Name: 2-(tert-butoxycarbonylamino)propanoic acid
IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
SYSTEMATIC NAME: 2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
MOLECULAR FORMULA: C8H15NO4
MOLECULAR WEIGHT: 189.209
SMILES: CC(C(=O)O)NC(=O)OC(C)(C)C
Structure:

CAS RN: 93433-87-5
CAS Name: N-methylcarbamic acid [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester
OPENEYE Name: [(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-methylcarbamate
IUPAC Name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-methylcarbamate
SYSTEMATIC NAME: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-methylcarbamate
MOLECULAR FORMULA: C29H49NO2
MOLECULAR WEIGHT: 443.70486
SMILES: C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)NC)C)C
Structure:

CAS RN: 20133-62-4
CAS Name: 5-ethyl-2-hydroxy-5-nitro-1,3,2$l^{5}-dioxaphosphorinane 2-oxide
OPENEYE Name: 5-ethyl-2-hydroxy-5-nitro-1,3,2$l^{5}-dioxaphosphinane 2-oxide
IUPAC Name: 5-ethyl-2-hydroxy-5-nitro-1,3,2$l^{5}-dioxaphosphinane 2-oxide
SYSTEMATIC NAME: 5-ethyl-5-nitro-2-oxidanyl-1,3,2$l^{5}-dioxaphosphinane 2-oxide
MOLECULAR FORMULA: C5H10NO6P
MOLECULAR WEIGHT: 211.109761
SMILES: CCC1(COP(=O)(OC1)O)[N+](=O)[O-]
Structure:

CAS RN: 46762-88-3
CAS Name: 5-methyl-2-oxo-N2-(phenylmethyl)-1,3,2$l^{5}-dioxaphosphorinane-2,5-diamine
OPENEYE Name: N2-benzyl-5-methyl-2-oxo-1,3,2$l^{5}-dioxaphosphinane-2,5-diamine
IUPAC Name: 2-N-benzyl-5-methyl-2-oxo-1,3,2$l^{5}-dioxaphosphinane-2,5-diamine
SYSTEMATIC NAME: 5-methyl-2-oxidanylidene-N2-(phenylmethyl)-1,3,2$l^{5}-dioxaphosphinane-2,5-diamine
MOLECULAR FORMULA: C11H17N2O3P
MOLECULAR WEIGHT: 256.238041
SMILES: CC1(COP(=O)(OC1)NCC2=CC=CC=C2)N
Structure:

CAS RN: 33704-60-8
CAS Name: 1-[3-(3-hydroxypropyl)-4-methoxyphenyl]ethanone
OPENEYE Name: 1-[3-(3-hydroxypropyl)-4-methoxy-phenyl]ethanone
IUPAC Name: 1-[3-(3-hydroxypropyl)-4-methoxyphenyl]ethanone
SYSTEMATIC NAME: 1-[4-methoxy-3-(3-oxidanylpropyl)phenyl]ethanone
MOLECULAR FORMULA: C12H16O3
MOLECULAR WEIGHT: 208.25364
SMILES: CC(=O)C1=CC(=C(C=C1)OC)CCCO
Structure:

CAS RN: 4546-68-3
CAS Name: 2-(hydroxymethyl)-5-(9-purinyl)-3-oxolanol
OPENEYE Name: 2-(hydroxymethyl)-5-purin-9-yl-tetrahydrofuran-3-ol
IUPAC Name: 2-(hydroxymethyl)-5-purin-9-yloxolan-3-ol
SYSTEMATIC NAME: 2-(hydroxymethyl)-5-purin-9-yl-oxolan-3-ol
MOLECULAR FORMULA: C10H12N4O3
MOLECULAR WEIGHT: 236.22728
SMILES: C1C(C(OC1N2C=NC3=CN=CN=C32)CO)O
Structure:

CAS RN: 4594-53-0
CAS Name: acetic acid [3-acetyloxy-5-(2,6-dichloro-9-purinyl)-2-oxolanyl]methyl ester
OPENEYE Name: [3-acetoxy-5-(2,6-dichloropurin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3-acetyloxy-5-(2,6-dichloropurin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3-acetyloxy-5-[2,6-bis(chloranyl)purin-9-yl]oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C14H14Cl2N4O5
MOLECULAR WEIGHT: 389.19076
SMILES: CC(=O)OCC1C(CC(O1)N2C=NC3=C2N=C(N=C3Cl)Cl)OC(=O)C
Structure:

CAS RN: 7057-48-9
CAS Name: [5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methanol
OPENEYE Name: [5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methanol
IUPAC Name: [5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methanol
SYSTEMATIC NAME: [5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methanol
MOLECULAR FORMULA: C10H11N5O2
MOLECULAR WEIGHT: 233.22664
SMILES: C1=CC(OC1CO)N2C=NC3=C2N=CN=C3N
Structure:

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