2-methyl-1-(2-methylphenyl)-6-oxidanylidene-N-(phenylmethyl)-4-(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: 2-methyl-1-(2-methylphenyl)-6-oxidanylidene-N-(phenylmethyl)-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-benzyl-2-methyl-1-(o-tolyl)-6-oxo-piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-2-methyl-1-(2-methylphenyl)-6-oxo-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-N-benzyl-2-methyl-1-(2-methylphenyl)-6-oxopiperazine-2-carboxamide Traditional Name: N-benzyl-4-besyl-6-keto-2-methyl-1-(o-tolyl)piperazine-2-carboxamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4S/c1-20-11-9-10-16-23(20)29-24(30)18-28(34(32,33)22-14-7-4-8-15-22)19-26(29,2)25(31)27-17-21-12-5-3-6-13-21/h3-16H,17-19H2,1-2H3,(H,27,31)