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

Systemtic Name: 2-methyl-N-(3-methylbutyl)-1-(2-methylphenyl)-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-isopentyl-2-methyl-1-(o-tolyl)-6-oxo-piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-2-methyl-N-(3-methylbutyl)-1-(2-methylphenyl)-6-oxo-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-2-methyl-N-(3-methylbutyl)-1-(2-methylphenyl)-6-oxopiperazine-2-carboxamide Traditional Name: 4-besyl-N-isoamyl-6-keto-2-methyl-1-(o-tolyl)piperazine-2-carboxamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O4S/c1-18(2)14-15-25-23(29)24(4)17-26(32(30,31)20-11-6-5-7-12-20)16-22(28)27(24)21-13-9-8-10-19(21)3/h5-13,18H,14-17H2,1-4H3,(H,25,29)