N-(7-methyloctyl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide

Systemtic Name: N-(7-methyloctyl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(7-methyloctyl)-4-oxo-butanamide CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-N-(7-methyloctyl)-4-oxobutanamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(7-methyloctyl)-4-oxobutanamide Traditional Name: 4-(4-besylpiperazino)-4-keto-N-(7-methyloctyl)butyramide Formula: C23H37N3O4S MolecularWeight: 451.62258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCNC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCCCCCNC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H37N3O4S/c1-20(2)10-6-3-4-9-15-24-22(27)13-14-23(28)25-16-18-26(19-17-25)31(29,30)21-11-7-5-8-12-21/h5,7-8,11-12,20H,3-4,6,9-10,13-19H2,1-2H3,(H,24,27)