CAS RN: 166772-80-1
CAS Name: 1-[2-[4-(2-methylphenyl)-1-piperazinyl]ethyl]-2-imidazolidinethione
OPENEYE Name: 1-[2-[4-(o-tolyl)piperazin-1-yl]ethyl]imidazolidine-2-thione
IUPAC Name: 1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]imidazolidine-2-thione
SYSTEMATIC NAME: 1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]imidazolidine-2-thione
MOLECULAR FORMULA: C16H24N4S
MOLECULAR WEIGHT: 304.45356
SMILES: CC1=CC=CC=C1N2CCN(CC2)CCN3CCNC3=S
Structure:
CAS RN: 166403-10-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H24O6
MOLECULAR WEIGHT: 336.37956
SMILES: CC1C2C(C3(CCCCC3C1(C(=O)C4=C(O2)C(OC4=O)C)C)O)O
Structure:
CAS RN: 166042-09-7
CAS Name: 1-(phenylmethyl)-7-propan-2-yl-3-(2H-tetrazol-5-yl)-2-cyclohepta[b]pyrrolone
OPENEYE Name: 1-benzyl-7-isopropyl-3-(2H-tetrazol-5-yl)cyclohepta[b]pyrrol-2-one
IUPAC Name: 1-benzyl-7-propan-2-yl-3-(2H-tetrazol-5-yl)cyclohepta[b]pyrrol-2-one
SYSTEMATIC NAME: 1-(phenylmethyl)-7-propan-2-yl-3-(2H-1,2,3,4-tetrazol-5-yl)cyclohepta[b]pyrrol-2-one
MOLECULAR FORMULA: C20H19N5O
MOLECULAR WEIGHT: 345.39776
SMILES: CC(C)C1=CC=CC2=C(C(=O)N(C2=C1)CC3=CC=CC=C3)C4=NNN=N4
Structure:
CAS RN: 165898-60-2
CAS Name: 9-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-1,3-dimethylpurino[7,8-a]pyrimidine-2,4,8-trione
OPENEYE Name: 9-[3-(4-benzhydrylpiperazin-1-yl)propyl]-1,3-dimethyl-purino[7,8-a]pyrimidine-2,4,8-trione
IUPAC Name: 9-[3-(4-benzhydrylpiperazin-1-yl)propyl]-1,3-dimethylpurino[7,8-a]pyrimidine-2,4,8-trione
SYSTEMATIC NAME: 9-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-1,3-dimethyl-purino[7,8-a]pyrimidine-2,4,8-trione
MOLECULAR FORMULA: C30H33N7O3
MOLECULAR WEIGHT: 539.62812
SMILES: CN1C2=C(C(=O)N(C1=O)C)N3C=CC(=O)N(C3=N2)CCCN4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6
Structure:
CAS RN: 165898-59-9
CAS Name: 1,3-dimethyl-9-[3-(4-phenyl-1-piperazinyl)propyl]purino[7,8-a]pyrimidine-2,4,8-trione
OPENEYE Name: 1,3-dimethyl-9-[3-(4-phenylpiperazin-1-yl)propyl]purino[7,8-a]pyrimidine-2,4,8-trione
IUPAC Name: 1,3-dimethyl-9-[3-(4-phenylpiperazin-1-yl)propyl]purino[7,8-a]pyrimidine-2,4,8-trione
SYSTEMATIC NAME: 1,3-dimethyl-9-[3-(4-phenylpiperazin-1-yl)propyl]purino[7,8-a]pyrimidine-2,4,8-trione
MOLECULAR FORMULA: C23H27N7O3
MOLECULAR WEIGHT: 449.50558
SMILES: CN1C2=C(C(=O)N(C1=O)C)N3C=CC(=O)N(C3=N2)CCCN4CCN(CC4)C5=CC=CC=C5
Structure:
CAS RN: 165611-08-5
CAS Name: 5-(chloromethyl)-6,7-diphenyl-5,7-dihydro-4H-isoxazolo[4,5-d]pyrimidine-3-carboxamide
OPENEYE Name: 5-(chloromethyl)-6,7-diphenyl-5,7-dihydro-4H-isoxazolo[4,5-d]pyrimidine-3-carboxamide
IUPAC Name: 5-(chloromethyl)-6,7-diphenyl-5,7-dihydro-4H-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
SYSTEMATIC NAME: 5-(chloromethyl)-6,7-diphenyl-5,7-dihydro-4H-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
MOLECULAR FORMULA: C19H17ClN4O2
MOLECULAR WEIGHT: 368.81688
SMILES: C1=CC=C(C=C1)C2C3=C(C(=NO3)C(=O)N)NC(N2C4=CC=CC=C4)CCl
Structure:
CAS RN: 165611-07-4
CAS Name: 6,7-diphenyl-5,7-dihydro-4H-isoxazolo[4,5-d]pyrimidine-3-carboxamide
OPENEYE Name: 6,7-diphenyl-5,7-dihydro-4H-isoxazolo[4,5-d]pyrimidine-3-carboxamide
IUPAC Name: 6,7-diphenyl-5,7-dihydro-4H-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
SYSTEMATIC NAME: 6,7-diphenyl-5,7-dihydro-4H-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
MOLECULAR FORMULA: C18H16N4O2
MOLECULAR WEIGHT: 320.34524
SMILES: C1NC2=C(C(N1C3=CC=CC=C3)C4=CC=CC=C4)ON=C2C(=O)N
Structure:
CAS RN: 165611-04-1
CAS Name: 6-oxido-7-phenyl-3-isoxazolo[4,5-d]pyrimidin-6-iumcarboxamide
OPENEYE Name: 6-oxido-7-phenyl-isoxazolo[4,5-d]pyrimidin-6-ium-3-carboxamide
IUPAC Name: 6-oxido-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidin-6-ium-3-carboxamide
SYSTEMATIC NAME: 6-oxidanidyl-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidin-6-ium-3-carboxamide
MOLECULAR FORMULA: C12H8N4O3
MOLECULAR WEIGHT: 256.21692
SMILES: C1=CC=C(C=C1)C2=[N+](C=NC3=C2ON=C3C(=O)N)[O-]
Structure:
CAS RN: 165611-03-0
CAS Name: 5-[(4-methyl-1-piperazinyl)methyl]-7-phenyl-3-isoxazolo[4,5-d]pyrimidinecarboxamide
OPENEYE Name: 5-[(4-methylpiperazin-1-yl)methyl]-7-phenyl-isoxazolo[4,5-d]pyrimidine-3-carboxamide
IUPAC Name: 5-[(4-methylpiperazin-1-yl)methyl]-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
SYSTEMATIC NAME: 5-[(4-methylpiperazin-1-yl)methyl]-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
MOLECULAR FORMULA: C18H20N6O2
MOLECULAR WEIGHT: 352.3904
SMILES: CN1CCN(CC1)CC2=NC3=C(C(=N2)C4=CC=CC=C4)ON=C3C(=O)N
Structure:
CAS RN: 165611-02-9
CAS Name: 5-[(methylthio)methyl]-7-phenyl-3-isoxazolo[4,5-d]pyrimidinecarboxamide
OPENEYE Name: 5-(methylsulfanylmethyl)-7-phenyl-isoxazolo[4,5-d]pyrimidine-3-carboxamide
IUPAC Name: 5-(methylsulfanylmethyl)-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
SYSTEMATIC NAME: 5-(methylsulfanylmethyl)-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
MOLECULAR FORMULA: C14H12N4O2S
MOLECULAR WEIGHT: 300.33568
SMILES: CSCC1=NC2=C(C(=N1)C3=CC=CC=C3)ON=C2C(=O)N
Structure:
CAS RN: 165611-01-8
CAS Name: 5-(chloromethyl)-7-phenyl-3-isoxazolo[4,5-d]pyrimidinecarboxamide
OPENEYE Name: 5-(chloromethyl)-7-phenyl-isoxazolo[4,5-d]pyrimidine-3-carboxamide
IUPAC Name: 5-(chloromethyl)-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
SYSTEMATIC NAME: 5-(chloromethyl)-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
MOLECULAR FORMULA: C13H9ClN4O2
MOLECULAR WEIGHT: 288.68916
SMILES: C1=CC=C(C=C1)C2=NC(=NC3=C2ON=C3C(=O)N)CCl
Structure:
CAS RN: 165337-66-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H21N5S
MOLECULAR WEIGHT: 327.44714
SMILES: CC1=CC(=NC2=C1C3=C(S2)C(=NC(=N3)C)N4CCN(CC4)C)C
Structure:
CAS RN: 165131-65-7
CAS Name: N,3-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphospholidin-2-amine
OPENEYE Name: N,3-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphospholidin-2-amine
IUPAC Name: N,3-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphospholidin-2-amine
SYSTEMATIC NAME: N,3-bis(2-chloroethyl)-2-oxidanylidene-1,3,2$l^{5}-oxazaphospholidin-2-amine
MOLECULAR FORMULA: C6H13Cl2N2O2P
MOLECULAR WEIGHT: 247.059381
SMILES: C1COP(=O)(N1CCCl)NCCCl
Structure:
CAS RN: 165131-64-6
CAS Name: N-(2-chloroethyl)-3-(3-chloropropyl)-2-oxo-1,3,2$l^{5}-oxazaphospholidin-2-amine
OPENEYE Name: N-(2-chloroethyl)-3-(3-chloropropyl)-2-oxo-1,3,2$l^{5}-oxazaphospholidin-2-amine
IUPAC Name: N-(2-chloroethyl)-3-(3-chloropropyl)-2-oxo-1,3,2$l^{5}-oxazaphospholidin-2-amine
SYSTEMATIC NAME: 3-(3-chloranylpropyl)-N-(2-chloroethyl)-2-oxidanylidene-1,3,2$l^{5}-oxazaphospholidin-2-amine
MOLECULAR FORMULA: C7H15Cl2N2O2P
MOLECULAR WEIGHT: 261.085961
SMILES: C1COP(=O)(N1CCCCl)NCCCl
Structure:
CAS RN: 164468-04-6
CAS Name: 2-butyl-1-[4-(2-pyrimidinyl)-1-piperazinyl]butane-1,3-dione
OPENEYE Name: 2-butyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,3-dione
IUPAC Name: 2-butyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,3-dione
SYSTEMATIC NAME: 2-butyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,3-dione
MOLECULAR FORMULA: C16H24N4O2
MOLECULAR WEIGHT: 304.38736
SMILES: CCCCC(C(=O)C)C(=O)N1CCN(CC1)C2=NC=CC=N2
Structure:
CAS RN: 164468-03-5
CAS Name: 3-[4-(2-pyrimidinyl)-1-piperazinyl]butanoic acid ethyl ester
OPENEYE Name: ethyl 3-(4-pyrimidin-2-ylpiperazin-1-yl)butanoate
IUPAC Name: ethyl 3-(4-pyrimidin-2-ylpiperazin-1-yl)butanoate
SYSTEMATIC NAME: ethyl 3-(4-pyrimidin-2-ylpiperazin-1-yl)butanoate
MOLECULAR FORMULA: C14H22N4O2
MOLECULAR WEIGHT: 278.35008
SMILES: CCOC(=O)CC(C)N1CCN(CC1)C2=NC=CC=N2
Structure:
CAS RN: 164468-02-4
CAS Name: 3-oxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]propanoic acid ethyl ester
OPENEYE Name: ethyl 3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanoate
IUPAC Name: ethyl 3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanoate
SYSTEMATIC NAME: ethyl 3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanoate
MOLECULAR FORMULA: C13H18N4O3
MOLECULAR WEIGHT: 278.30702
SMILES: CCOC(=O)CC(=O)N1CCN(CC1)C2=NC=CC=N2
Structure:
CAS RN: 164468-01-3
CAS Name: 1-[4-(2-pyrimidinyl)-1-piperazinyl]butane-1,3-dione
OPENEYE Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,3-dione
IUPAC Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,3-dione
SYSTEMATIC NAME: 1-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,3-dione
MOLECULAR FORMULA: C12H16N4O2
MOLECULAR WEIGHT: 248.28104
SMILES: CC(=O)CC(=O)N1CCN(CC1)C2=NC=CC=N2
Structure:
CAS RN: 164455-27-0
CAS Name: (4S,6S)-4-amino-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide hydrochloride
OPENEYE Name: (4S,6S)-4-amino-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide hydrochloride
IUPAC Name: (4S,6S)-4-amino-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide hydrochloride
SYSTEMATIC NAME: (4S,6S)-4-azanyl-6-methyl-7,7-bis(oxidanylidene)-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide hydrochloride
MOLECULAR FORMULA: C8H13ClN2O4S3
MOLECULAR WEIGHT: 332.84782
SMILES: C[C@H]1C[C@@H](C2=C(S1(=O)=O)SC(=C2)S(=O)(=O)N)N.Cl
Structure:
CAS RN: 164357-38-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H34N6O2S
MOLECULAR WEIGHT: 542.69496
SMILES: CC1=CC(=NC2=C1C3=NN(C(=C3N(S2(=O)=O)CCCN4CCN(CC4)C5=CC=CC=C5)C6=CC=CC=C6)C)C
Structure:
CAS RN: 164357-37-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H30N8O2S
MOLECULAR WEIGHT: 482.6017
SMILES: CC1=CC(=NC2=C1C3=NN(C(=C3N(S2(=O)=O)CCCN4CCN(CC4)C5=NC=CC=N5)C)C)C
Structure:
CAS RN: 164357-36-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H31N7O2S
MOLECULAR WEIGHT: 481.61364
SMILES: CC1=CC(=NC2=C1C3=NN(C(=C3N(S2(=O)=O)CCCN4CCN(CC4)C5=CC=CC=N5)C)C)C
Structure:
CAS RN: 164357-33-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H32N6O2S
MOLECULAR WEIGHT: 480.62558
SMILES: CC1=CC(=NC2=C1C3=NN(C(=C3N(S2(=O)=O)CCCN4CCN(CC4)C5=CC=CC=C5)C)C)C
Structure:
CAS RN: 164357-31-7
CAS Name: 1-[4-hydroxy-5,7-dimethyl-1,1-dioxo-2-[3-(4-phenyl-1-piperazinyl)propyl]-3-pyrido[3,2-e]thiazinyl]ethanone
OPENEYE Name: 1-[4-hydroxy-5,7-dimethyl-1,1-dioxo-2-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[3,2-e]thiazin-3-yl]ethanone
IUPAC Name: 1-[4-hydroxy-5,7-dimethyl-1,1-dioxo-2-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[3,2-e]thiazin-3-yl]ethanone
SYSTEMATIC NAME: 1-[5,7-dimethyl-4-oxidanyl-1,1-bis(oxidanylidene)-2-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[3,2-e][1,2]thiazin-3-yl]ethanone
MOLECULAR FORMULA: C24H30N4O4S
MOLECULAR WEIGHT: 470.5844
SMILES: CC1=CC(=NC2=C1C(=C(N(S2(=O)=O)CCCN3CCN(CC3)C4=CC=CC=C4)C(=O)C)O)C
Structure:
CAS RN: 164120-30-3
CAS Name: 1-(2-chloroethyl)-3-[(3S,7R,10R,13R,17R)-3-hydroxy-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-7-yl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[(3S,7R,10R,13R,17R)-17-[(1R)-1,5-dimethylhexyl]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[(3S,7R,10R,13R,17R)-3-hydroxy-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-7-yl]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[(3S,7R,10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]-1-nitroso-urea
MOLECULAR FORMULA: C30H50ClN3O3
MOLECULAR WEIGHT: 536.1893
SMILES: C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2[C@H](C=C4[C@@]3(CC[C@@H](C4)O)C)NC(=O)N(CCCl)N=O)C
Structure:
CAS RN: 164120-29-0
CAS Name: 1-(2-chloroethyl)-3-[[(3S,7R,10R,13R,17R)-3-hydroxy-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-7-yl]methyl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[[(3S,7R,10R,13R,17R)-17-[(1R)-1,5-dimethylhexyl]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]methyl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[[(3S,7R,10R,13R,17R)-3-hydroxy-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-7-yl]methyl]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[[(3S,7R,10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]methyl]-1-nitroso-urea
MOLECULAR FORMULA: C31H52ClN3O3
MOLECULAR WEIGHT: 550.21588
SMILES: C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2[C@H](C=C4[C@@]3(CC[C@@H](C4)O)C)CNC(=O)N(CCCl)N=O)C
Structure:
CAS RN: 164120-28-9
CAS Name: 1-(2-chloroethyl)-3-[[(3S,7S,10R,13R,17R)-3-hydroxy-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-7-yl]methyl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[[(3S,7S,10R,13R,17R)-17-[(1R)-1,5-dimethylhexyl]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]methyl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[[(3S,7S,10R,13R,17R)-3-hydroxy-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-7-yl]methyl]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[[(3S,7S,10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]methyl]-1-nitroso-urea
MOLECULAR FORMULA: C31H52ClN3O3
MOLECULAR WEIGHT: 550.21588
SMILES: C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2[C@@H](C=C4[C@@]3(CC[C@@H](C4)O)C)CNC(=O)N(CCCl)N=O)C
Structure:
CAS RN: 164120-27-8
CAS Name: 1-(2-chloroethyl)-3-[3-hydroxy-2-[(3S,7R,10R,13R,17R)-3-hydroxy-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-7-yl]propyl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[2-[(3S,7R,10R,13R,17R)-17-[(1R)-1,5-dimethylhexyl]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]-3-hydroxy-propyl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[3-hydroxy-2-[(3S,7R,10R,13R,17R)-3-hydroxy-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-7-yl]propyl]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[2-[(3S,7R,10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]-3-oxidanyl-propyl]-1-nitroso-urea
MOLECULAR FORMULA: C33H56ClN3O4
MOLECULAR WEIGHT: 594.26844
SMILES: C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2[C@H](C=C4[C@@]3(CC[C@@H](C4)O)C)C(CNC(=O)N(CCCl)N=O)CO)C
Structure:
CAS RN: 164120-26-7
CAS Name: 1-(2-chloroethyl)-3-[2-[(3S,7R,10R,13R,17R)-3-hydroxy-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-7-yl]ethyl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[2-[(3S,7R,10R,13R,17R)-17-[(1R)-1,5-dimethylhexyl]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]ethyl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[2-[(3S,7R,10R,13R,17R)-3-hydroxy-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-7-yl]ethyl]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[2-[(3S,7R,10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]ethyl]-1-nitroso-urea
MOLECULAR FORMULA: C32H54ClN3O3
MOLECULAR WEIGHT: 564.24246
SMILES: C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2[C@H](C=C4[C@@]3(CC[C@@H](C4)O)C)CCNC(=O)N(CCCl)N=O)C
Structure:
CAS RN: 164071-40-3
CAS Name: 2,6,7-trimethyl-3-[3-(4-phenyl-1-piperazinyl)propyl]pyrido[3,4-d]pyridazine-1,4,5-trione
OPENEYE Name: 2,6,7-trimethyl-3-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[3,4-d]pyridazine-1,4,5-trione
IUPAC Name: 2,6,7-trimethyl-3-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[3,4-d]pyridazine-1,4,5-trione
SYSTEMATIC NAME: 2,6,7-trimethyl-3-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[3,4-d]pyridazine-1,4,5-trione
MOLECULAR FORMULA: C23H29N5O3
MOLECULAR WEIGHT: 423.50806
SMILES: CC1=CC2=C(C(=O)N1C)C(=O)N(N(C2=O)C)CCCN3CCN(CC3)C4=CC=CC=C4
Structure:
CAS RN: 164071-36-7
CAS Name: 2-[3-[4-(2-chlorophenyl)-1-piperazinyl]propyl]-3,7-dimethyl-5-(1-piperidinyl)pyrido[3,4-d]pyridazine-1,4-dione
OPENEYE Name: 2-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-3,7-dimethyl-5-(1-piperidyl)pyrido[3,4-d]pyridazine-1,4-dione
IUPAC Name: 2-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-3,7-dimethyl-5-piperidin-1-ylpyrido[3,4-d]pyridazine-1,4-dione
SYSTEMATIC NAME: 2-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-3,7-dimethyl-5-piperidin-1-yl-pyrido[3,4-d]pyridazine-1,4-dione
MOLECULAR FORMULA: C27H35ClN6O2
MOLECULAR WEIGHT: 511.0588
SMILES: CC1=NC(=C2C(=C1)C(=O)N(N(C2=O)C)CCCN3CCN(CC3)C4=CC=CC=C4Cl)N5CCCCC5
Structure:
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