N-[2-(4-chlorophenyl)ethyl]-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-oxo-4-[4-(p-tolylsulfonyl)piperazin-1-yl]butanamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxobutanamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-keto-4-(4-tosylpiperazino)butyramide Formula: C23H28ClN3O4S MolecularWeight: 478.00412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28ClN3O4S/c1-18-2-8-21(9-3-18)32(30,31)27-16-14-26(15-17-27)23(29)11-10-22(28)25-13-12-19-4-6-20(24)7-5-19/h2-9H,10-17H2,1H3,(H,25,28)