4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-N-(3-phenylpropyl)butanamide

Systemtic Name: 4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-N-(3-phenylpropyl)butanamide Openeye Name: 4-oxo-N-(3-phenylpropyl)-4-[4-(p-tolylsulfonyl)piperazin-1-yl]butanamide CAS Name: 4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-oxo-N-(3-phenylpropyl)butanamide IUPAC Name: 4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxo-N-(3-phenylpropyl)butanamide Traditional Name: 4-keto-N-(3-phenylpropyl)-4-(4-tosylpiperazino)butyramide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O4S/c1-20-9-11-22(12-10-20)32(30,31)27-18-16-26(17-19-27)24(29)14-13-23(28)25-15-5-8-21-6-3-2-4-7-21/h2-4,6-7,9-12H,5,8,13-19H2,1H3,(H,25,28)