Product OPENEYE NAME: 1-[3-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-4-methoxy-phenyl]ethanone
CAS Name: 1-[3-[[4-(benzenesulfonyl)-1-piperazin-1-iumyl]methyl]-4-methoxyphenyl]ethanone
IUPAC NAME: 1-[3-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-4-methoxyphenyl]ethanone
SYSTEMATIC NAME: 1-[4-methoxy-3-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone
MOLECULAR FORMULA: C20H25N2O4S+
MOLECULAR WEIGHT: 389.4885
SMILES: CC(=O)C1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1-[3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-4-methoxy-phenyl]ethanone
CAS Name: 1-[3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-4-methoxyphenyl]ethanone
IUPAC NAME: 1-[3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-4-methoxyphenyl]ethanone
SYSTEMATIC NAME: 1-[4-methoxy-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]phenyl]ethanone
MOLECULAR FORMULA: C20H24N2O4S
MOLECULAR WEIGHT: 388.48056
SMILES: CC(=O)C1=CC(=C(C=C1)OC)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (E)-3-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]prop-2-enamide
CAS Name: (E)-3-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-propenamide
IUPAC NAME: (E)-3-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]prop-2-enamide
SYSTEMATIC NAME: (E)-3-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]prop-2-enamide
MOLECULAR FORMULA: C18H17F2NOS
MOLECULAR WEIGHT: 333.395486
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)/C=C/C2=CC=C(C=C2)F)F
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Product OPENEYE NAME: (1R)-2,2-dichloro-N-(3,4-dimethylphenyl)cyclopropanecarboxamide
CAS Name: (1R)-2,2-dichloro-N-(3,4-dimethylphenyl)-1-cyclopropanecarboxamide
IUPAC NAME: (1R)-2,2-dichloro-N-(3,4-dimethylphenyl)cyclopropane-1-carboxamide
SYSTEMATIC NAME: (1R)-2,2-bis(chloranyl)-N-(3,4-dimethylphenyl)cyclopropane-1-carboxamide
MOLECULAR FORMULA: C12H13Cl2NO
MOLECULAR WEIGHT: 258.14372
SMILES: CC1=C(C=C(C=C1)NC(=O)[C@H]2CC2(Cl)Cl)C
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(4-tert-butylphenoxy)acetate
CAS Name: 2-(4-tert-butylphenoxy)acetic acid [(2S)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(4-tert-butylphenoxy)acetate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(4-tert-butylphenoxy)ethanoate
MOLECULAR FORMULA: C21H29N3O4
MOLECULAR WEIGHT: 387.47266
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@H](C)OC(=O)COC2=CC=C(C=C2)C(C)(C)C
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(1R)-1-methylpropyl]acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-[(2R)-butan-2-yl]acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(2R)-butan-2-yl]acetamide
SYSTEMATIC NAME: N-[(2R)-butan-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C16H26N3O3S+
MOLECULAR WEIGHT: 340.46094
SMILES: CC[C@@H](C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(1R)-1-methylpropyl]acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(2R)-butan-2-yl]acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2R)-butan-2-yl]acetamide
SYSTEMATIC NAME: N-[(2R)-butan-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C16H25N3O3S
MOLECULAR WEIGHT: 339.453
SMILES: CC[C@@H](C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 1-(3-acetylphenyl)sulfonyl-N-(3,4-dimethylphenyl)piperidine-4-carboxamide
CAS Name: 1-(3-acetylphenyl)sulfonyl-N-(3,4-dimethylphenyl)-4-piperidinecarboxamide
IUPAC NAME: 1-(3-acetylphenyl)sulfonyl-N-(3,4-dimethylphenyl)piperidine-4-carboxamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide
MOLECULAR FORMULA: C22H26N2O4S
MOLECULAR WEIGHT: 414.51784
SMILES: CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C)C
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-pyrrolidin-1-ylsulfonylbenzamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide
MOLECULAR FORMULA: C20H23FN2O3S2
MOLECULAR WEIGHT: 422.536623
SMILES: C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3F
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(1S)-1-methylpropyl]acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-[(2S)-butan-2-yl]acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(2S)-butan-2-yl]acetamide
SYSTEMATIC NAME: N-[(2S)-butan-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C16H26N3O3S+
MOLECULAR WEIGHT: 340.46094
SMILES: CC[C@H](C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(1S)-1-methylpropyl]acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(2S)-butan-2-yl]acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2S)-butan-2-yl]acetamide
SYSTEMATIC NAME: N-[(2S)-butan-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C16H25N3O3S
MOLECULAR WEIGHT: 339.453
SMILES: CC[C@H](C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: (2S)-N-(3,4-dimethylphenyl)-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide
CAS Name: (2S)-N-(3,4-dimethylphenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide
IUPAC NAME: (2S)-N-(3,4-dimethylphenyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide
SYSTEMATIC NAME: (2S)-N-(3,4-dimethylphenyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide
MOLECULAR FORMULA: C20H24N2O2S
MOLECULAR WEIGHT: 356.48176
SMILES: CC1=CC=C(C=C1)NC(=O)CS[C@@H](C)C(=O)NC2=CC(=C(C=C2)C)C
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Product OPENEYE NAME: [(1R)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 2-(4-tert-butylphenoxy)acetate
CAS Name: 2-(4-tert-butylphenoxy)acetic 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] 2-(4-tert-butylphenoxy)acetate
SYSTEMATIC NAME: [(2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-(4-tert-butylphenoxy)ethanoate
MOLECULAR FORMULA: C23H29NO5
MOLECULAR WEIGHT: 399.48006
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@@H](C)OC(=O)COC2=CC=C(C=C2)C(C)(C)C
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Product OPENEYE NAME: [(1S)-2-(benzylamino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-(benzylamino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H19NO4
MOLECULAR WEIGHT: 337.36916
SMILES: C[C@@H](C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-butyl-acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-butylacetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-butylacetamide
SYSTEMATIC NAME: N-butyl-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C16H26N3O3S+
MOLECULAR WEIGHT: 340.46094
SMILES: CCCCNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-butyl-acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-butylacetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-butylacetamide
SYSTEMATIC NAME: N-butyl-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C16H25N3O3S
MOLECULAR WEIGHT: 339.453
SMILES: CCCCNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: (2R)-N-(3,4-dimethylphenyl)-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide
CAS Name: (2R)-N-(3,4-dimethylphenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide
IUPAC NAME: (2R)-N-(3,4-dimethylphenyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide
SYSTEMATIC NAME: (2R)-N-(3,4-dimethylphenyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide
MOLECULAR FORMULA: C20H24N2O2S
MOLECULAR WEIGHT: 356.48176
SMILES: CC1=CC=C(C=C1)NC(=O)CS[C@H](C)C(=O)NC2=CC(=C(C=C2)C)C
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Product OPENEYE NAME: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]prop-2-enamide
CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-propenamide
IUPAC NAME: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]prop-2-enamide
SYSTEMATIC NAME: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]prop-2-enamide
MOLECULAR FORMULA: C19H18FNO3S
MOLECULAR WEIGHT: 359.414523
SMILES: C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)NCCSCC3=CC=CC=C3F
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Product OPENEYE NAME: [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 2-(4-tert-butylphenoxy)acetate
CAS Name: 2-(4-tert-butylphenoxy)acetic 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] 2-(4-tert-butylphenoxy)acetate
SYSTEMATIC NAME: [(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-(4-tert-butylphenoxy)ethanoate
MOLECULAR FORMULA: C23H29NO5
MOLECULAR WEIGHT: 399.48006
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@H](C)OC(=O)COC2=CC=C(C=C2)C(C)(C)C
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-isopentyl-acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-(3-methylbutyl)acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-(3-methylbutyl)acetamide
SYSTEMATIC NAME: N-(3-methylbutyl)-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C17H28N3O3S+
MOLECULAR WEIGHT: 354.48752
SMILES: CC(C)CCNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-isopentyl-acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-(3-methylbutyl)acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(3-methylbutyl)acetamide
SYSTEMATIC NAME: N-(3-methylbutyl)-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C17H27N3O3S
MOLECULAR WEIGHT: 353.47958
SMILES: CC(C)CCNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 3-(4,5-dihydrothiazol-2-ylsulfanylmethyl)-N-(3,4-dimethylphenyl)benzofuran-2-carboxamide
CAS Name: 3-[(4,5-dihydrothiazol-2-ylthio)methyl]-N-(3,4-dimethylphenyl)-2-benzofurancarboxamide
IUPAC NAME: 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-N-(3,4-dimethylphenyl)-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-N-(3,4-dimethylphenyl)-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C21H20N2O2S2
MOLECULAR WEIGHT: 396.5257
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NCCS4)C
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