Friday, July 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: (6Z)-6-[5-(butylamino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
CAS Name: (6Z)-6-[5-(butylamino)-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,4-dienone
IUPAC NAME: (6Z)-6-[5-(butylamino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-[5-(butylamino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C12H15N3O2
MOLECULAR WEIGHT: 233.2664
SMILES: CCCCNC1=NN/C(=C/2\C=CC=CC2=O)/O1
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Product OPENEYE NAME: (6Z)-6-[5-(cyclohexylamino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
CAS Name: (6Z)-6-[5-(cyclohexylamino)-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,4-dienone
IUPAC NAME: (6Z)-6-[5-(cyclohexylamino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-[5-(cyclohexylamino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H17N3O2
MOLECULAR WEIGHT: 259.30368
SMILES: C1CCC(CC1)NC2=NN/C(=C/3\C=CC=CC3=O)/O2
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Product OPENEYE NAME: (6Z)-6-(5-anilino-3H-1,3,4-oxadiazol-2-ylidene)-2,4-dibromo-cyclohexa-2,4-dien-1-one
CAS Name: (6Z)-6-(5-anilino-3H-1,3,4-oxadiazol-2-ylidene)-2,4-dibromo-1-cyclohexa-2,4-dienone
IUPAC NAME: (6Z)-6-(5-anilino-3H-1,3,4-oxadiazol-2-ylidene)-2,4-dibromocyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-2,4-bis(bromanyl)-6-(5-phenylazanyl-3H-1,3,4-oxadiazol-2-ylidene)cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H9Br2N3O2
MOLECULAR WEIGHT: 411.04816
SMILES: C1=CC=C(C=C1)NC2=NN/C(=C/3\C=C(C=C(C3=O)Br)Br)/O2
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Product OPENEYE NAME: (6Z)-2,4-dibromo-6-[5-(4-methylanilino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
CAS Name: (6Z)-2,4-dibromo-6-[5-(4-methylanilino)-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,4-dienone
IUPAC NAME: (6Z)-2,4-dibromo-6-[5-(4-methylanilino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-2,4-bis(bromanyl)-6-[5-[(4-methylphenyl)amino]-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C15H11Br2N3O2
MOLECULAR WEIGHT: 425.07474
SMILES: CC1=CC=C(C=C1)NC2=NN/C(=C/3\C=C(C=C(C3=O)Br)Br)/O2
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Product OPENEYE NAME: (6Z)-2,4-dibromo-6-[5-(4-methoxyanilino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
CAS Name: (6Z)-2,4-dibromo-6-[5-(4-methoxyanilino)-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,4-dienone
IUPAC NAME: (6Z)-2,4-dibromo-6-[5-(4-methoxyanilino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-2,4-bis(bromanyl)-6-[5-[(4-methoxyphenyl)amino]-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C15H11Br2N3O3
MOLECULAR WEIGHT: 441.07414
SMILES: COC1=CC=C(C=C1)NC2=NN/C(=C/3\C=C(C=C(C3=O)Br)Br)/O2
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Product OPENEYE NAME: (6Z)-2,4-dibromo-6-[5-(4-chloroanilino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
CAS Name: (6Z)-2,4-dibromo-6-[5-(4-chloroanilino)-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,4-dienone
IUPAC NAME: (6Z)-2,4-dibromo-6-[5-(4-chloroanilino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-2,4-bis(bromanyl)-6-[5-[(4-chlorophenyl)amino]-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H8Br2ClN3O2
MOLECULAR WEIGHT: 445.49322
SMILES: C1=CC(=CC=C1NC2=NN/C(=C/3\C=C(C=C(C3=O)Br)Br)/O2)Cl
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Product OPENEYE NAME: (6Z)-2,4-dibromo-6-[5-(4-bromoanilino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
CAS Name: (6Z)-2,4-dibromo-6-[5-(4-bromoanilino)-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,4-dienone
IUPAC NAME: (6Z)-2,4-dibromo-6-[5-(4-bromoanilino)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-2,4-bis(bromanyl)-6-[5-[(4-bromophenyl)amino]-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H8Br3N3O2
MOLECULAR WEIGHT: 489.94422
SMILES: C1=CC(=CC=C1NC2=NN/C(=C/3\C=C(C=C(C3=O)Br)Br)/O2)Br
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Product OPENEYE NAME: ethyl 2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]acetate
CAS Name: 2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]acetate
SYSTEMATIC NAME: ethyl 2-[(8R,9S,13S,14S,17R)-3-methoxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethanoate
MOLECULAR FORMULA: C23H32O4
MOLECULAR WEIGHT: 372.49778
SMILES: CCOC(=O)C[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)OC)C)O
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Product OPENEYE NAME: 2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]acetohydrazide
CAS Name: 2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]acetohydrazide
IUPAC NAME: 2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]acetohydrazide
SYSTEMATIC NAME: 2-[(8R,9S,13S,14S,17R)-3-methoxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethanehydrazide
MOLECULAR FORMULA: C21H30N2O3
MOLECULAR WEIGHT: 358.4745
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(CC(=O)NN)O)CCC4=C3C=CC(=C4)OC
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Product OPENEYE NAME: 1-[[2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]acetyl]amino]-3-phenyl-thiourea
CAS Name: 1-[[2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-1-oxoethyl]amino]-3-phenylthiourea
IUPAC NAME: 1-[[2-[(8R,9S,13S,14S,17R)-17-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]acetyl]amino]-3-phenylthiourea
SYSTEMATIC NAME: 1-[2-[(8R,9S,13S,14S,17R)-3-methoxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethanoylamino]-3-phenyl-thiourea
MOLECULAR FORMULA: C28H35N3O3S
MOLECULAR WEIGHT: 493.6608
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(CC(=O)NNC(=S)NC4=CC=CC=C4)O)CCC5=C3C=CC(=C5)OC
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