Product OPENEYE NAME: 3-[4-(benzenesulfonyl)piperazin-1-yl]propanenitrile
CAS Name: 3-[4-(benzenesulfonyl)-1-piperazinyl]propanenitrile
IUPAC NAME: 3-[4-(benzenesulfonyl)piperazin-1-yl]propanenitrile
SYSTEMATIC NAME: 3-[4-(phenylsulfonyl)piperazin-1-yl]propanenitrile
MOLECULAR FORMULA: C13H17N3O2S
MOLECULAR WEIGHT: 279.35798
SMILES: C1CN(CCN1CCC#N)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,3,4-trimethoxy-benzamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2,3,4-trimethoxybenzamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,3,4-trimethoxybenzamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,3,4-trimethoxy-benzamide
MOLECULAR FORMULA: C19H22FNO4S
MOLECULAR WEIGHT: 379.445683
SMILES: COC1=C(C(=C(C=C1)C(=O)NCCSCC2=CC=CC=C2F)OC)OC
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Product OPENEYE NAME: N-allyl-4-(benzenesulfonyl)piperazine-1-carbothioamide
CAS Name: 4-(benzenesulfonyl)-N-prop-2-enyl-1-piperazinecarbothioamide
IUPAC NAME: 4-(benzenesulfonyl)-N-prop-2-enylpiperazine-1-carbothioamide
SYSTEMATIC NAME: 4-(phenylsulfonyl)-N-prop-2-enyl-piperazine-1-carbothioamide
MOLECULAR FORMULA: C14H19N3O2S2
MOLECULAR WEIGHT: 325.44956
SMILES: C=CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: [(1R)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate
CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate
SYSTEMATIC NAME: [(2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate
MOLECULAR FORMULA: C21H22N2O4S
MOLECULAR WEIGHT: 398.47538
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@@H](C)OC(=O)CCC2=NC3=CC=CC=C3S2
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Product OPENEYE NAME: N-(1-adamantyl)-2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]acetamide
CAS Name: N-(1-adamantyl)-2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-(1-adamantyl)-2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-(1-adamantyl)-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C22H32N3O3S+
MOLECULAR WEIGHT: 418.57278
SMILES: C1CN(CC[NH+]1CC(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC=C5
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Product OPENEYE NAME: N-(1-adamantyl)-2-[4-(benzenesulfonyl)piperazin-1-yl]acetamide
CAS Name: N-(1-adamantyl)-2-[4-(benzenesulfonyl)-1-piperazinyl]acetamide
IUPAC NAME: N-(1-adamantyl)-2-[4-(benzenesulfonyl)piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(1-adamantyl)-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C22H31N3O3S
MOLECULAR WEIGHT: 417.56484
SMILES: C1CN(CCN1CC(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC=C5
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Product OPENEYE NAME: (3S,7aR)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
CAS Name: (3S,7aR)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
IUPAC NAME: (3S,7aR)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
SYSTEMATIC NAME: (3S,7aR)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxidanylidene-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
MOLECULAR FORMULA: C16H20N2O2S
MOLECULAR WEIGHT: 304.4072
SMILES: CC1=C(C=C(C=C1)NC(=O)[C@H]2CS[C@]3(N2C(=O)CC3)C)C
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Product OPENEYE NAME: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester
IUPAC NAME: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2H-chromene-3-carboxylate
SYSTEMATIC NAME: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C19H14N2O4
MOLECULAR WEIGHT: 334.32546
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC3=NN=C(O3)C4=CC=CC=C4
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide
CAS Name: N-(3,4-dimethylphenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide
IUPAC NAME: N-(3,4-dimethylphenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-carboxamide
MOLECULAR FORMULA: C17H15N3O3
MOLECULAR WEIGHT: 309.3193
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)NC(=O)C(=O)N3)C
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-[(2-methoxyphenyl)methyl]acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide
SYSTEMATIC NAME: N-[(2-methoxyphenyl)methyl]-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C20H26N3O4S+
MOLECULAR WEIGHT: 404.50314
SMILES: COC1=CC=CC=C1CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(2-methoxyphenyl)methyl]acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide
SYSTEMATIC NAME: N-[(2-methoxyphenyl)methyl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H25N3O4S
MOLECULAR WEIGHT: 403.4952
SMILES: COC1=CC=CC=C1CNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 4-(benzenesulfonyl)-N-(4-chlorophenyl)piperazine-1-carbothioamide
CAS Name: 4-(benzenesulfonyl)-N-(4-chlorophenyl)-1-piperazinecarbothioamide
IUPAC NAME: 4-(benzenesulfonyl)-N-(4-chlorophenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-4-(phenylsulfonyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C17H18ClN3O2S2
MOLECULAR WEIGHT: 395.92672
SMILES: C1CN(CCN1C(=S)NC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2,4-difluoro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
CAS Name: 2,4-difluoro-N-[2-[(2-fluorophenyl)methylthio]ethyl]benzamide
IUPAC NAME: 2,4-difluoro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
SYSTEMATIC NAME: 2,4-bis(fluoranyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
MOLECULAR FORMULA: C16H14F3NOS
MOLECULAR WEIGHT: 325.34867
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)C2=C(C=C(C=C2)F)F)F
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Product OPENEYE NAME: [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate
CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate
SYSTEMATIC NAME: [(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate
MOLECULAR FORMULA: C21H22N2O4S
MOLECULAR WEIGHT: 398.47538
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@H](C)OC(=O)CCC2=NC3=CC=CC=C3S2
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Product OPENEYE NAME: [2-(2,5-difluorophenyl)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(2,5-difluorophenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(2,5-difluorophenyl)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H12F2O4
MOLECULAR WEIGHT: 330.282286
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)C3=C(C=CC(=C3)F)F
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Product OPENEYE NAME: (E)-2-cyano-N-(3,4-dimethylphenyl)-3-[2,5-dimethyl-1-[[(2S)-tetrahydrofuran-2-yl]methyl]pyrrol-3-yl]prop-2-enamide
CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2S)-2-oxolanyl]methyl]-3-pyrrolyl]-N-(3,4-dimethylphenyl)-2-propenamide
IUPAC NAME: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2S)-oxolan-2-yl]methyl]pyrrol-3-yl]-N-(3,4-dimethylphenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2S)-oxolan-2-yl]methyl]pyrrol-3-yl]-N-(3,4-dimethylphenyl)prop-2-enamide
MOLECULAR FORMULA: C23H27N3O2
MOLECULAR WEIGHT: 377.47938
SMILES: CC1=C(C=C(C=C1)NC(=O)/C(=C/C2=C(N(C(=C2)C)C[C@@H]3CCCO3)C)/C#N)C
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Product OPENEYE NAME: 4-(benzenesulfonyl)-N-ethyl-piperazine-1-carbothioamide
CAS Name: 4-(benzenesulfonyl)-N-ethyl-1-piperazinecarbothioamide
IUPAC NAME: 4-(benzenesulfonyl)-N-ethylpiperazine-1-carbothioamide
SYSTEMATIC NAME: N-ethyl-4-(phenylsulfonyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C13H19N3O2S2
MOLECULAR WEIGHT: 313.43886
SMILES: CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 4-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxo-butanamide
CAS Name: 4-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-oxobutanamide
IUPAC NAME: 4-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxobutanamide
SYSTEMATIC NAME: 4-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-butanamide
MOLECULAR FORMULA: C19H19F2NO2S
MOLECULAR WEIGHT: 363.421466
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)CCC(=O)C2=CC=C(C=C2)F)F
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-(2-furylmethyl)acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-(2-furanylmethyl)acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)acetamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C17H22N3O4S+
MOLECULAR WEIGHT: 364.43928
SMILES: C1CN(CC[NH+]1CC(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(2-furylmethyl)acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-(2-furanylmethyl)acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(furan-2-ylmethyl)acetamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C17H21N3O4S
MOLECULAR WEIGHT: 363.43134
SMILES: C1CN(CCN1CC(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [2-oxo-2-(2-oxooxazolidin-3-yl)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate
CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [2-oxo-2-(2-oxo-3-oxazolidinyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2-oxidanylidene-1,3-oxazolidin-3-yl)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate
MOLECULAR FORMULA: C15H14N2O5S
MOLECULAR WEIGHT: 334.34706
SMILES: C1COC(=O)N1C(=O)COC(=O)CCC2=NC3=CC=CC=C3S2
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-(2-cyanoethyl)-N-phenyl-acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-(2-cyanoethyl)-N-phenylacetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-(2-cyanoethyl)-N-phenylacetamide
SYSTEMATIC NAME: N-(2-cyanoethyl)-N-phenyl-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C21H25N4O3S+
MOLECULAR WEIGHT: 413.5132
SMILES: C1CN(CC[NH+]1CC(=O)N(CCC#N)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(2-cyanoethyl)-N-phenyl-acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-(2-cyanoethyl)-N-phenylacetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(2-cyanoethyl)-N-phenylacetamide
SYSTEMATIC NAME: N-(2-cyanoethyl)-N-phenyl-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C21H24N4O3S
MOLECULAR WEIGHT: 412.50526
SMILES: C1CN(CCN1CC(=O)N(CCC#N)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3
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