N-[2-(2-methylphenyl)ethyl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[2-(2-methylphenyl)ethyl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[2-(o-tolyl)ethyl]acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[2-(2-methylphenyl)ethyl]acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[2-(2-methylphenyl)ethyl]acetamide Traditional Name: 2-(4-besylpiperazino)-N-[2-(o-tolyl)ethyl]acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-18-7-5-6-8-19(18)11-12-22-21(25)17-23-13-15-24(16-14-23)28(26,27)20-9-3-2-4-10-20/h2-10H,11-17H2,1H3,(H,22,25)