Product OPENEYE NAME: 4-[6-(2-chloro-4-hydroxy-phenyl)-6a-(4-chlorophenyl)-8-(4-fluoroanilino)-1,3,7,9-tetraoxo-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]butanoic acid
CAS Name: 4-[6-(2-chloro-4-hydroxyphenyl)-6a-(4-chlorophenyl)-8-(4-fluoroanilino)-1,3,7,9-tetraoxo-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]butanoic acid
IUPAC NAME: 4-[6-(2-chloro-4-hydroxyphenyl)-6a-(4-chlorophenyl)-8-(4-fluoroanilino)-1,3,7,9-tetraoxo-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]butanoic acid
SYSTEMATIC NAME: 4-[6-(2-chloranyl-4-oxidanyl-phenyl)-6a-(4-chlorophenyl)-8-[(4-fluorophenyl)amino]-1,3,7,9-tetrakis(oxidanylidene)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]butanoic acid
MOLECULAR FORMULA: C36H30Cl2FN3O7
MOLECULAR WEIGHT: 706.543703
SMILES: C1C=C2C(CC3C(=O)N(C(=O)C3(C2C4=C(C=C(C=C4)O)Cl)C5=CC=C(C=C5)Cl)NC6=CC=C(C=C6)F)C7C1C(=O)N(C7=O)CCCC(=O)O
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Product OPENEYE NAME: 3-[6-(3-bromo-4-hydroxy-5-methoxy-phenyl)-6a-(4-chlorophenyl)-8-(4-fluoroanilino)-1,3,7,9-tetraoxo-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]benzoic acid
CAS Name: 3-[6-(3-bromo-4-hydroxy-5-methoxyphenyl)-6a-(4-chlorophenyl)-8-(4-fluoroanilino)-1,3,7,9-tetraoxo-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]benzoic acid
IUPAC NAME: 3-[6-(3-bromo-4-hydroxy-5-methoxyphenyl)-6a-(4-chlorophenyl)-8-(4-fluoroanilino)-1,3,7,9-tetraoxo-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]benzoic acid
SYSTEMATIC NAME: 3-[6-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-6a-(4-chlorophenyl)-8-[(4-fluorophenyl)amino]-1,3,7,9-tetrakis(oxidanylidene)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindol-2-yl]benzoic acid
MOLECULAR FORMULA: C40H30BrClFN3O8
MOLECULAR WEIGHT: 815.036903
SMILES: COC1=C(C(=CC(=C1)C2C3=CCC4C(C3CC5C2(C(=O)N(C5=O)NC6=CC=C(C=C6)F)C7=CC=C(C=C7)Cl)C(=O)N(C4=O)C8=CC=CC(=C8)C(=O)O)Br)O
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Product OPENEYE NAME: 2-benzyl-6a-(4-chlorophenyl)-8-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]-6-[4-(2-hydroxyethoxy)phenyl]-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 6a-(4-chlorophenyl)-8-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-6-[4-(2-hydroxyethoxy)phenyl]-2-(phenylmethyl)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 2-benzyl-6a-(4-chlorophenyl)-8-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]-6-[4-(2-hydroxyethoxy)phenyl]-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 8-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]-6a-(4-chlorophenyl)-6-[4-(2-hydroxyethyloxy)phenyl]-2-(phenylmethyl)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C41H33Cl2F3N4O6
MOLECULAR WEIGHT: 805.62513
SMILES: C1C=C2C(CC3C(=O)N(C(=O)C3(C2C4=CC=C(C=C4)OCCO)C5=CC=C(C=C5)Cl)NC6=C(C=C(C=N6)C(F)(F)F)Cl)C7C1C(=O)N(C7=O)CC8=CC=CC=C8
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Product OPENEYE NAME: 2-(4-acetylphenyl)-8-(2,4-dichloroanilino)-6-(4-hydroxy-2-methoxy-phenyl)-6a-(4-methoxyphenyl)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 2-(4-acetylphenyl)-8-(2,4-dichloroanilino)-6-(4-hydroxy-2-methoxyphenyl)-6a-(4-methoxyphenyl)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 2-(4-acetylphenyl)-8-(2,4-dichloroanilino)-6-(4-hydroxy-2-methoxyphenyl)-6a-(4-methoxyphenyl)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 8-[(2,4-dichlorophenyl)amino]-2-(4-ethanoylphenyl)-6-(2-methoxy-4-oxidanyl-phenyl)-6a-(4-methoxyphenyl)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C42H35Cl2N3O8
MOLECULAR WEIGHT: 780.6486
SMILES: CC(=O)C1=CC=C(C=C1)N2C(=O)C3CC=C4C(C3C2=O)CC5C(=O)N(C(=O)C5(C4C6=C(C=C(C=C6)O)OC)C7=CC=C(C=C7)OC)NC8=C(C=C(C=C8)Cl)Cl
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Product OPENEYE NAME: ethyl 4-[(6-ethoxy-2-thioxo-1,3-benzothiazol-3-yl)methyl]piperazine-1-carboxylate
CAS Name: 4-[(6-ethoxy-2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]-1-piperazinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[(6-ethoxy-2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]piperazine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[(6-ethoxy-2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]piperazine-1-carboxylate
MOLECULAR FORMULA: C17H23N3O3S2
MOLECULAR WEIGHT: 381.51282
SMILES: CCOC1=CC2=C(C=C1)N(C(=S)S2)CN3CCN(CC3)C(=O)OCC
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Product OPENEYE NAME: 6-(propylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
CAS Name: 6-[oxo(propylamino)methyl]-1-cyclohex-3-enecarboxylic acid
IUPAC NAME: 6-(propylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
SYSTEMATIC NAME: 6-(propylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
MOLECULAR FORMULA: C11H17NO3
MOLECULAR WEIGHT: 211.25758
SMILES: CCCNC(=O)C1CC=CCC1C(=O)O
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Product OPENEYE NAME: 1-(4-chlorophenyl)-3-(4-pyridylmethyl)urea
CAS Name: 1-(4-chlorophenyl)-3-(pyridin-4-ylmethyl)urea
IUPAC NAME: 1-(4-chlorophenyl)-3-(pyridin-4-ylmethyl)urea
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-(pyridin-4-ylmethyl)urea
MOLECULAR FORMULA: C13H12ClN3O
MOLECULAR WEIGHT: 261.70688
SMILES: C1=CC(=CC=C1NC(=O)NCC2=CC=NC=C2)Cl
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Product OPENEYE NAME: 2-ethyl-N,N-dihexyl-hexanamide
CAS Name: 2-ethyl-N,N-dihexylhexanamide
IUPAC NAME: 2-ethyl-N,N-dihexylhexanamide
SYSTEMATIC NAME: 2-ethyl-N,N-dihexyl-hexanamide
MOLECULAR FORMULA: C20H41NO
MOLECULAR WEIGHT: 311.54564
SMILES: CCCCCCN(CCCCCC)C(=O)C(CC)CCCC
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Product OPENEYE NAME: ethyl 4-methyl-2-[3-(5-methyl-2-furyl)prop-2-enoylamino]thiazole-5-carboxylate
CAS Name: 4-methyl-2-[[3-(5-methyl-2-furanyl)-1-oxoprop-2-enyl]amino]-5-thiazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-methyl-2-[3-(5-methylfuran-2-yl)prop-2-enoylamino]-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: ethyl 4-methyl-2-[3-(5-methylfuran-2-yl)prop-2-enoylamino]-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C15H16N2O4S
MOLECULAR WEIGHT: 320.36354
SMILES: CCOC(=O)C1=C(N=C(S1)NC(=O)C=CC2=CC=C(O2)C)C
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Product OPENEYE NAME: N-cyclohexylpyrazole-1-carboxamide
CAS Name: N-cyclohexyl-1-pyrazolecarboxamide
IUPAC NAME: N-cyclohexylpyrazole-1-carboxamide
SYSTEMATIC NAME: N-cyclohexylpyrazole-1-carboxamide
MOLECULAR FORMULA: C10H15N3O
MOLECULAR WEIGHT: 193.2456
SMILES: C1CCC(CC1)NC(=O)N2C=CC=N2
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Product OPENEYE NAME: N-(2-methyl-5-sulfamoyl-phenyl)-2-(m-tolyl)quinoline-4-carboxamide
CAS Name: 2-(3-methylphenyl)-N-(2-methyl-5-sulfamoylphenyl)-4-quinolinecarboxamide
IUPAC NAME: 2-(3-methylphenyl)-N-(2-methyl-5-sulfamoylphenyl)quinoline-4-carboxamide
SYSTEMATIC NAME: 2-(3-methylphenyl)-N-(2-methyl-5-sulfamoyl-phenyl)quinoline-4-carboxamide
MOLECULAR FORMULA: C24H21N3O3S
MOLECULAR WEIGHT: 431.50684
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)C
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Product OPENEYE NAME: ethyl 5-acetyl-4-methyl-2-[3-(5-methyl-2-furyl)prop-2-enoylamino]thiophene-3-carboxylate
CAS Name: 5-acetyl-4-methyl-2-[[3-(5-methyl-2-furanyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester
IUPAC NAME: ethyl 5-acetyl-4-methyl-2-[3-(5-methylfuran-2-yl)prop-2-enoylamino]thiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 5-ethanoyl-4-methyl-2-[3-(5-methylfuran-2-yl)prop-2-enoylamino]thiophene-3-carboxylate
MOLECULAR FORMULA: C18H19NO5S
MOLECULAR WEIGHT: 361.41216
SMILES: CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C=CC2=CC=C(O2)C
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Product OPENEYE NAME: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N-(2-phenylethyl)heptanamide
CAS Name: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N-(2-phenylethyl)heptanamide
IUPAC NAME: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N-(2-phenylethyl)heptanamide
SYSTEMATIC NAME: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecakis(fluoranyl)-N-(2-phenylethyl)heptanamide
MOLECULAR FORMULA: C15H10F13NO
MOLECULAR WEIGHT: 467.225242
SMILES: C1=CC=C(C=C1)CCNC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
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Product OPENEYE NAME: 2-benzamido-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide
CAS Name: 2-benzamido-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide
IUPAC NAME: 2-benzamido-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide
SYSTEMATIC NAME: 2-benzamido-N-(6-chloranyl-1,3-benzothiazol-2-yl)benzamide
MOLECULAR FORMULA: C21H14ClN3O2S
MOLECULAR WEIGHT: 407.87276
SMILES: C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl
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Product OPENEYE NAME: 3-(6-methyl-4,5,6,7-tetrahydrobenzothiophen-3-yl)-4-(m-tolyl)-1H-1,2,4-triazole-5-thione
CAS Name: 4-(3-methylphenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione
IUPAC NAME: 4-(3-methylphenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 4-(3-methylphenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C18H19N3S2
MOLECULAR WEIGHT: 341.49356
SMILES: CC1CCC2=C(C1)SC=C2C3=NNC(=S)N3C4=CC=CC(=C4)C
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Product OPENEYE NAME: N-[1-(5-bromo-2-thienyl)propylideneamino]-2-hydroxy-3,5-diisopropyl-benzamide
CAS Name: N-[1-(5-bromo-2-thiophenyl)propylideneamino]-2-hydroxy-3,5-di(propan-2-yl)benzamide
IUPAC NAME: N-[1-(5-bromothiophen-2-yl)propylideneamino]-2-hydroxy-3,5-di(propan-2-yl)benzamide
SYSTEMATIC NAME: N-[1-(5-bromanylthiophen-2-yl)propylideneamino]-2-oxidanyl-3,5-di(propan-2-yl)benzamide
MOLECULAR FORMULA: C20H25BrN2O2S
MOLECULAR WEIGHT: 437.3937
SMILES: CCC(=NNC(=O)C1=CC(=CC(=C1O)C(C)C)C(C)C)C2=CC=C(S2)Br
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Product OPENEYE NAME: isopropyl 2-[(5-ethylthiophene-3-carbonyl)amino]-6-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Name: 2-[[(5-ethyl-3-thiophenyl)-oxomethyl]amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propan-2-yl ester
IUPAC NAME: propan-2-yl 2-[(5-ethylthiophene-3-carbonyl)amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SYSTEMATIC NAME: propan-2-yl 2-[(5-ethylthiophen-3-yl)carbonylamino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
MOLECULAR FORMULA: C25H27NO3S2
MOLECULAR WEIGHT: 453.61678
SMILES: CCC1=CC(=CS1)C(=O)NC2=C(C3=C(S2)CC(CC3)C4=CC=CC=C4)C(=O)OC(C)C
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Product OPENEYE NAME: tris(2,4-dimethoxyphenyl)phosphane
CAS Name: tris(2,4-dimethoxyphenyl)phosphine
IUPAC NAME: tris(2,4-dimethoxyphenyl)phosphane
SYSTEMATIC NAME: tris(2,4-dimethoxyphenyl)phosphane
MOLECULAR FORMULA: C24H27O6P
MOLECULAR WEIGHT: 442.441341
SMILES: COC1=CC(=C(C=C1)P(C2=C(C=C(C=C2)OC)OC)C3=C(C=C(C=C3)OC)OC)OC
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Product OPENEYE NAME: [3-(4-benzylpyridin-1-ium-1-yl)quinoxalin-2-yl]-(3-nitrophenyl)sulfonyl-azanide
CAS Name: (3-nitrophenyl)sulfonyl-[3-[4-(phenylmethyl)-1-pyridin-1-iumyl]-2-quinoxalinyl]azanide
IUPAC NAME: [3-(4-benzylpyridin-1-ium-1-yl)quinoxalin-2-yl]-(3-nitrophenyl)sulfonylazanide
SYSTEMATIC NAME: (3-nitrophenyl)sulfonyl-[3-[4-(phenylmethyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]azanide
MOLECULAR FORMULA: C26H19N5O4S
MOLECULAR WEIGHT: 497.52516
SMILES: C1=CC=C(C=C1)CC2=CC=[N+](C=C2)C3=NC4=CC=CC=C4N=C3[N-]S(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]
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Product OPENEYE NAME: N-[3-(4-benzylpyridin-1-ium-1-yl)quinoxalin-2-yl]-3-nitro-benzenesulfonamide
CAS Name: 3-nitro-N-[3-[4-(phenylmethyl)-1-pyridin-1-iumyl]-2-quinoxalinyl]benzenesulfonamide
IUPAC NAME: N-[3-(4-benzylpyridin-1-ium-1-yl)quinoxalin-2-yl]-3-nitrobenzenesulfonamide
SYSTEMATIC NAME: 3-nitro-N-[3-[4-(phenylmethyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide
MOLECULAR FORMULA: C26H20N5O4S+
MOLECULAR WEIGHT: 498.5331
SMILES: C1=CC=C(C=C1)CC2=CC=[N+](C=C2)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H23N3O3
MOLECULAR WEIGHT: 377.43632
SMILES: CCOC(=O)C1CC2=CC=C(CCC3=CC=C(CC1C(=O)N=[N+]=[N-])C=C3)C=C2
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Product OPENEYE NAME: 3-methyl-2-phenyl-butanoate
CAS Name: 3-methyl-2-phenylbutanoate
IUPAC NAME: 3-methyl-2-phenylbutanoate
SYSTEMATIC NAME: 3-methyl-2-phenyl-butanoate
MOLECULAR FORMULA: C11H13O2-
MOLECULAR WEIGHT: 177.21972
SMILES: CC(C)C(C1=CC=CC=C1)C(=O)[O-]
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