2-methyl-N-(3-methylbutyl)-6-oxidanylidene-1-(3-phenylpropyl)-4-(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: 2-methyl-N-(3-methylbutyl)-6-oxidanylidene-1-(3-phenylpropyl)-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-isopentyl-2-methyl-6-oxo-1-(3-phenylpropyl)piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-2-methyl-N-(3-methylbutyl)-6-oxo-1-(3-phenylpropyl)-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-2-methyl-N-(3-methylbutyl)-6-oxo-1-(3-phenylpropyl)piperazine-2-carboxamide Traditional Name: 4-besyl-N-isoamyl-6-keto-2-methyl-1-(3-phenylpropyl)piperazine-2-carboxamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1(CN(CC(=O)N1CCCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC(C)CCNC(=O)C1(CN(CC(=O)N1CCCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C26H35N3O4S/c1-21(2)16-17-27-25(31)26(3)20-28(34(32,33)23-14-8-5-9-15-23)19-24(30)29(26)18-10-13-22-11-6-4-7-12-22/h4-9,11-12,14-15,21H,10,13,16-20H2,1-3H3,(H,27,31)