Product OPENEYE NAME: 4,7-diamino-2-phenyl-pteridine-6-carboxamide
CAS Name: 4,7-diamino-2-phenyl-6-pteridinecarboxamide
IUPAC NAME: 4,7-diamino-2-phenylpteridine-6-carboxamide
SYSTEMATIC NAME: 4,7-bis(azanyl)-2-phenyl-pteridine-6-carboxamide
MOLECULAR FORMULA: C13H11N7O
MOLECULAR WEIGHT: 281.27274
SMILES: C1=CC=C(C=C1)C2=NC3=C(C(=N2)N)N=C(C(=N3)N)C(=O)N
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Product OPENEYE NAME: 5-(4H-imidazol-2-ylmethyl)-6,11-dihydrobenzo[c][1]benzazepine
CAS Name: 5-(4H-imidazol-2-ylmethyl)-6,11-dihydrobenzo[c][1]benzazepine
IUPAC NAME: 5-(4H-imidazol-2-ylmethyl)-6,11-dihydrobenzo[c][1]benzazepine
SYSTEMATIC NAME: 5-(4H-imidazol-2-ylmethyl)-6,11-dihydrobenzo[c][1]benzazepine
MOLECULAR FORMULA: C18H17N3
MOLECULAR WEIGHT: 275.34768
SMILES: C1C=NC(=N1)CN2CC3=CC=CC=C3CC4=CC=CC=C42
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Product OPENEYE NAME: 4,6-diphenoxy-1,3,5-triazin-2-amine
CAS Name: 4,6-diphenoxy-1,3,5-triazin-2-amine
IUPAC NAME: 4,6-diphenoxy-1,3,5-triazin-2-amine
SYSTEMATIC NAME: 4,6-diphenoxy-1,3,5-triazin-2-amine
MOLECULAR FORMULA: C15H12N4O2
MOLECULAR WEIGHT: 280.28138
SMILES: C1=CC=C(C=C1)OC2=NC(=NC(=N2)N)OC3=CC=CC=C3
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Product OPENEYE NAME: 9-[3-(4-fluorophenoxy)propyl]-9-azaspiro[5.5]undecane
CAS Name: 9-[3-(4-fluorophenoxy)propyl]-9-azaspiro[5.5]undecane
IUPAC NAME: 9-[3-(4-fluorophenoxy)propyl]-9-azaspiro[5.5]undecane
SYSTEMATIC NAME: 9-[3-(4-fluoranylphenoxy)propyl]-9-azaspiro[5.5]undecane
MOLECULAR FORMULA: C19H28FNO
MOLECULAR WEIGHT: 305.430123
SMILES: C1CCC2(CC1)CCN(CC2)CCCOC3=CC=C(C=C3)F
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Product OPENEYE NAME: (3S,8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
CAS Name: (3S,8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
IUPAC NAME: (3S,8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
SYSTEMATIC NAME: (3S,8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
MOLECULAR FORMULA: C20H28O2
MOLECULAR WEIGHT: 300.43512
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C[C@H](CC[C@H]34)O
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Product OPENEYE NAME: (16R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,16,17-tetrol
CAS Name: (16R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,16,17-tetrol
IUPAC NAME: (16R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,16,17-tetrol
SYSTEMATIC NAME: (16R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,16,17-tetrol
MOLECULAR FORMULA: C18H24O4
MOLECULAR WEIGHT: 304.38076
SMILES: CC12CCC3C(C1C[C@H](C2O)O)CCC4=CC(=C(C=C34)O)O
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Product OPENEYE NAME: 2-methyl-2-(1-naphthyl)-4-(1-piperidyl)butanenitrile
CAS Name: 2-methyl-2-(1-naphthalenyl)-4-(1-piperidinyl)butanenitrile
IUPAC NAME: 2-methyl-2-naphthalen-1-yl-4-piperidin-1-ylbutanenitrile
SYSTEMATIC NAME: 2-methyl-2-naphthalen-1-yl-4-piperidin-1-yl-butanenitrile
MOLECULAR FORMULA: C20H24N2
MOLECULAR WEIGHT: 292.41796
SMILES: CC(CCN1CCCCC1)(C#N)C2=CC=CC3=CC=CC=C32
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Product OPENEYE NAME: N,N-dimethyl-3-(5-methyl-6H-benzo[c][1]benzazepin-11-ylidene)propan-1-amine
CAS Name: N,N-dimethyl-3-(5-methyl-6H-benzo[c][1]benzazepin-11-ylidene)-1-propanamine
IUPAC NAME: N,N-dimethyl-3-(5-methyl-6H-benzo[c][1]benzazepin-11-ylidene)propan-1-amine
SYSTEMATIC NAME: N,N-dimethyl-3-(5-methyl-6H-benzo[c][1]benzazepin-11-ylidene)propan-1-amine
MOLECULAR FORMULA: C20H24N2
MOLECULAR WEIGHT: 292.41796
SMILES: CN1CC2=CC=CC=C2C(=CCCN(C)C)C3=CC=CC=C31
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Product OPENEYE NAME: 2-(dimethylamino)ethanol; 2-methyl-4-(4-phenylphenyl)butanoic acid
CAS Name: 2-(dimethylamino)ethanol; 2-methyl-4-(4-phenylphenyl)butanoic acid
IUPAC NAME: 2-(dimethylamino)ethanol; 2-methyl-4-(4-phenylphenyl)butanoic acid
SYSTEMATIC NAME: 2-(dimethylamino)ethanol; 2-methyl-4-(4-phenylphenyl)butanoic acid
MOLECULAR FORMULA: C21H29NO3
MOLECULAR WEIGHT: 343.45986
SMILES: CC(CCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O.CN(C)CCO
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Product OPENEYE NAME: 2-methyl-4-(4-phenylphenyl)butanoic acid
CAS Name: 2-methyl-4-(4-phenylphenyl)butanoic acid
IUPAC NAME: 2-methyl-4-(4-phenylphenyl)butanoic acid
SYSTEMATIC NAME: 2-methyl-4-(4-phenylphenyl)butanoic acid
MOLECULAR FORMULA: C17H18O2
MOLECULAR WEIGHT: 254.32362
SMILES: CC(CCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O
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Product OPENEYE NAME: 4-(3-azaspiro[4.6]undecan-3-yl)-1-(4-fluorophenyl)butan-1-one
CAS Name: 4-(3-azaspiro[4.6]undecan-3-yl)-1-(4-fluorophenyl)-1-butanone
IUPAC NAME: 4-(3-azaspiro[4.6]undecan-3-yl)-1-(4-fluorophenyl)butan-1-one
SYSTEMATIC NAME: 4-(3-azaspiro[4.6]undecan-3-yl)-1-(4-fluorophenyl)butan-1-one
MOLECULAR FORMULA: C20H28FNO
MOLECULAR WEIGHT: 317.440823
SMILES: C1CCCC2(CC1)CCN(C2)CCCC(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: methyl (1R,4aS,10aR)-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
CAS Name: (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester
IUPAC NAME: methyl (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
SYSTEMATIC NAME: methyl (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
MOLECULAR FORMULA: C21H30O2
MOLECULAR WEIGHT: 314.4617
SMILES: CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)C(=O)OC)C
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Product OPENEYE NAME: 17-ethynyl-10,17-dihydroxy-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
CAS Name: 17-ethynyl-10,17-dihydroxy-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
IUPAC NAME: 17-ethynyl-10,17-dihydroxy-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: 17-ethynyl-13-methyl-10,17-bis(oxidanyl)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C20H26O3
MOLECULAR WEIGHT: 314.41864
SMILES: CC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34O
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Product OPENEYE NAME: N,N-bis(2-fluoroethyl)-4-[(4-methoxyphenyl)iminomethyl]aniline
CAS Name: N,N-bis(2-fluoroethyl)-4-[(4-methoxyphenyl)iminomethyl]aniline
IUPAC NAME: N,N-bis(2-fluoroethyl)-4-[(4-methoxyphenyl)iminomethyl]aniline
SYSTEMATIC NAME: N,N-bis(2-fluoranylethyl)-4-[(4-methoxyphenyl)iminomethyl]aniline
MOLECULAR FORMULA: C18H20F2N2O
MOLECULAR WEIGHT: 318.361006
SMILES: COC1=CC=C(C=C1)N=CC2=CC=C(C=C2)N(CCF)CCF
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Product OPENEYE NAME: 17-ethynyl-10-hydroperoxy-17-hydroxy-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
CAS Name: 17-ethynyl-10-hydroperoxy-17-hydroxy-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
IUPAC NAME: 17-ethynyl-10-hydroperoxy-17-hydroxy-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: 10-(dioxidanyl)-17-ethynyl-13-methyl-17-oxidanyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C20H26O4
MOLECULAR WEIGHT: 330.41804
SMILES: CC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34OO
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Product OPENEYE NAME: 3-methyl-2-(2-morpholinoethyl)-2-(1-naphthyl)butanenitrile
CAS Name: 3-methyl-2-[2-(4-morpholinyl)ethyl]-2-(1-naphthalenyl)butanenitrile
IUPAC NAME: 3-methyl-2-(2-morpholin-4-ylethyl)-2-naphthalen-1-ylbutanenitrile
SYSTEMATIC NAME: 3-methyl-2-(2-morpholin-4-ylethyl)-2-naphthalen-1-yl-butanenitrile
MOLECULAR FORMULA: C21H26N2O
MOLECULAR WEIGHT: 322.44394
SMILES: CC(C)C(CCN1CCOCC1)(C#N)C2=CC=CC3=CC=CC=C32
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Product OPENEYE NAME: 4-(7,9-dimethyl-8-oxa-3-azaspiro[4.5]decan-3-yl)-1-(4-fluorophenyl)butan-1-one
CAS Name: 4-(7,9-dimethyl-8-oxa-3-azaspiro[4.5]decan-3-yl)-1-(4-fluorophenyl)-1-butanone
IUPAC NAME: 4-(7,9-dimethyl-8-oxa-3-azaspiro[4.5]decan-3-yl)-1-(4-fluorophenyl)butan-1-one
SYSTEMATIC NAME: 4-(7,9-dimethyl-8-oxa-3-azaspiro[4.5]decan-3-yl)-1-(4-fluorophenyl)butan-1-one
MOLECULAR FORMULA: C20H28FNO2
MOLECULAR WEIGHT: 333.440223
SMILES: CC1CC2(CCN(C2)CCCC(=O)C3=CC=C(C=C3)F)CC(O1)C
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C22H28BrNO
MOLECULAR WEIGHT: 402.36782
SMILES: CC1C2CC3=C(C1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)O.Br
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C22H27NO
MOLECULAR WEIGHT: 321.45588
SMILES: CC1C2CC3=C(C1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)O
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MOLECULAR FORMULA: C20H30N2O2
MOLECULAR WEIGHT: 330.4644
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(CC5=NON=C5C4)C
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