4-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)-1-(phenylcarbonyl)piperazine-2-carboxamide

Systemtic Name: 4-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)-1-(phenylcarbonyl)piperazine-2-carboxamide Openeye Name: 1-benzoyl-N-isobutyl-4-(p-tolylsulfonyl)piperazine-2-carboxamide CAS Name: 1-benzoyl-4-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)-2-piperazinecarboxamide IUPAC Name: 1-benzoyl-4-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)piperazine-2-carboxamide Traditional Name: 1-benzoyl-N-isobutyl-4-tosyl-piperazine-2-carboxamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(C2)C(=O)NCC(C)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(C2)C(=O)NCC(C)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O4S/c1-17(2)15-24-22(27)21-16-25(31(29,30)20-11-9-18(3)10-12-20)13-14-26(21)23(28)19-7-5-4-6-8-19/h4-12,17,21H,13-16H2,1-3H3,(H,24,27)