N-[2-(2-methylphenyl)ethyl]-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[2-(2-methylphenyl)ethyl]-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-[2-(o-tolyl)ethyl]acetamide CAS Name: N-[2-(2-methylphenyl)ethyl]-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide Traditional Name: 2-(4-benzylsulfonylpiperazino)-N-[2-(o-tolyl)ethyl]acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-19-7-5-6-10-21(19)11-12-23-22(26)17-24-13-15-25(16-14-24)29(27,28)18-20-8-3-2-4-9-20/h2-10H,11-18H2,1H3,(H,23,26)