Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C14H21N3O3S
MOLECULAR WEIGHT: 311.39984
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)N
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Product OPENEYE NAME: (3S,7aS)-N-(4-fluorophenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
CAS Name: (3S,7aS)-N-(4-fluorophenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
IUPAC NAME: (3S,7aS)-N-(4-fluorophenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
SYSTEMATIC NAME: (3S,7aS)-N-(4-fluorophenyl)-7a-methyl-5-oxidanylidene-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
MOLECULAR FORMULA: C14H15FN2O2S
MOLECULAR WEIGHT: 294.344503
SMILES: C[C@]12CCC(=O)N1[C@H](CS2)C(=O)NC3=CC=C(C=C3)F
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Product OPENEYE NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazine-1,4-diium-1-yl]-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CAS Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazine-1,4-diiumyl]-N-[(1R,2S)-2-methylcyclohexyl]acetamide
IUPAC NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazine-1,4-diium-1-yl]-N-[(1R,2S)-2-methylcyclohexyl]acetamide
SYSTEMATIC NAME: 2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1,4-diium-1-yl]-N-[(1R,2S)-2-methylcyclohexyl]ethanamide
MOLECULAR FORMULA: C23H38N4O2+2
MOLECULAR WEIGHT: 402.57342
SMILES: C[C@H]1CCCC[C@H]1NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazin-1-yl]-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CAS Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazinyl]-N-[(1R,2S)-2-methylcyclohexyl]acetamide
IUPAC NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-yl]-N-[(1R,2S)-2-methylcyclohexyl]acetamide
SYSTEMATIC NAME: 2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(1R,2S)-2-methylcyclohexyl]ethanamide
MOLECULAR FORMULA: C23H36N4O2
MOLECULAR WEIGHT: 400.55754
SMILES: C[C@H]1CCCC[C@H]1NC(=O)CN2CCN(CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: [(1S)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-(1-adamantylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(1-adamantylamino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C23H27NO4
MOLECULAR WEIGHT: 381.46478
SMILES: C[C@@H](C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)C4=CC5=CC=CC=C5OC4
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Product OPENEYE NAME: (E)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(3-methyl-2-thienyl)prop-2-enamide
CAS Name: (E)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-3-(3-methyl-2-thiophenyl)-2-propenamide
IUPAC NAME: (E)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(3-methylthiophen-2-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(3-methylthiophen-2-yl)prop-2-enamide
MOLECULAR FORMULA: C17H18FNOS2
MOLECULAR WEIGHT: 335.459323
SMILES: CC1=C(SC=C1)/C=C/C(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: methyl 4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
CAS Name: 4-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
MOLECULAR FORMULA: C21H27N2O4S+
MOLECULAR WEIGHT: 403.51508
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)C(=O)OC
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Product OPENEYE NAME: methyl 4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]benzoate
CAS Name: 4-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]benzoate
MOLECULAR FORMULA: C21H26N2O4S
MOLECULAR WEIGHT: 402.50714
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)OC
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Product OPENEYE NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-propyl-piperazine-1-carbothioamide
CAS Name: 4-(2,5-dimethylphenyl)sulfonyl-N-propyl-1-piperazinecarbothioamide
IUPAC NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-propylpiperazine-1-carbothioamide
SYSTEMATIC NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-propyl-piperazine-1-carbothioamide
MOLECULAR FORMULA: C16H25N3O2S2
MOLECULAR WEIGHT: 355.5186
SMILES: CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C
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Product OPENEYE NAME: 2-(1,3-dioxoisoindolin-2-yl)ethyl (2S)-2-(butylsulfonylamino)propanoate
CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester
IUPAC NAME: 2-(1,3-dioxoisoindol-2-yl)ethyl (2S)-2-(butylsulfonylamino)propanoate
SYSTEMATIC NAME: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (2S)-2-(butylsulfonylamino)propanoate
MOLECULAR FORMULA: C17H22N2O6S
MOLECULAR WEIGHT: 382.43138
SMILES: CCCCS(=O)(=O)N[C@@H](C)C(=O)OCCN1C(=O)C2=CC=CC=C2C1=O
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Product OPENEYE NAME: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2S)-tetrahydrofuran-2-yl]methyl]pyrrol-3-yl]-N-(4-fluorophenyl)prop-2-enamide
CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2S)-2-oxolanyl]methyl]-3-pyrrolyl]-N-(4-fluorophenyl)-2-propenamide
IUPAC NAME: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2S)-oxolan-2-yl]methyl]pyrrol-3-yl]-N-(4-fluorophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2S)-oxolan-2-yl]methyl]pyrrol-3-yl]-N-(4-fluorophenyl)prop-2-enamide
MOLECULAR FORMULA: C21H22FN3O2
MOLECULAR WEIGHT: 367.416683
SMILES: CC1=CC(=C(N1C[C@@H]2CCCO2)C)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)F
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Product OPENEYE NAME: [(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C23H27NO4
MOLECULAR WEIGHT: 381.46478
SMILES: C[C@H](C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)C4=CC5=CC=CC=C5OC4
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Product OPENEYE NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazine-1,4-diium-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
CAS Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazine-1,4-diiumyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
IUPAC NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazine-1,4-diium-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
SYSTEMATIC NAME: 2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1,4-diium-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide
MOLECULAR FORMULA: C23H38N4O2+2
MOLECULAR WEIGHT: 402.57342
SMILES: C[C@H]1CCCC[C@@H]1NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
CAS Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
IUPAC NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
SYSTEMATIC NAME: 2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide
MOLECULAR FORMULA: C23H36N4O2
MOLECULAR WEIGHT: 400.55754
SMILES: C[C@H]1CCCC[C@@H]1NC(=O)CN2CCN(CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: 4-(ethylsulfamoyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
CAS Name: 4-(ethylsulfamoyl)-N-[2-[(2-fluorophenyl)methylthio]ethyl]benzamide
IUPAC NAME: 4-(ethylsulfamoyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
SYSTEMATIC NAME: 4-(ethylsulfamoyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
MOLECULAR FORMULA: C18H21FN2O3S2
MOLECULAR WEIGHT: 396.499343
SMILES: CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazine-1-carbothioamide
CAS Name: 4-(2,5-dimethylphenyl)sulfonyl-N-[[(2S)-2-oxolanyl]methyl]-1-piperazinecarbothioamide
IUPAC NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-[[(2S)-oxolan-2-yl]methyl]piperazine-1-carbothioamide
SYSTEMATIC NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-[[(2S)-oxolan-2-yl]methyl]piperazine-1-carbothioamide
MOLECULAR FORMULA: C18H27N3O3S2
MOLECULAR WEIGHT: 397.55528
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=S)NC[C@@H]3CCCO3
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Product OPENEYE NAME: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-3-yl]-N-(4-fluorophenyl)prop-2-enamide
CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-2-oxolanyl]methyl]-3-pyrrolyl]-N-(4-fluorophenyl)-2-propenamide
IUPAC NAME: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-3-yl]-N-(4-fluorophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-3-yl]-N-(4-fluorophenyl)prop-2-enamide
MOLECULAR FORMULA: C21H22FN3O2
MOLECULAR WEIGHT: 367.416683
SMILES: CC1=CC(=C(N1C[C@H]2CCCO2)C)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)F
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[[(2S)-tetrahydropyran-2-yl]methyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[[(2S)-2-oxanyl]methyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[[(2S)-oxan-2-yl]methyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[[(2S)-oxan-2-yl]methyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C20H33N3O2+2
MOLECULAR WEIGHT: 347.49492
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)C[C@@H]3CCCCO3
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[[(2S)-tetrahydropyran-2-yl]methyl]piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[[(2S)-2-oxanyl]methyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[[(2S)-oxan-2-yl]methyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[[(2S)-oxan-2-yl]methyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H31N3O2
MOLECULAR WEIGHT: 345.47904
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C[C@@H]3CCCCO3
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