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

Systemtic Name: N-(3-methylbutyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-isopentyl-4-oxo-4-[4-(p-tolylsulfonyl)piperazin-1-yl]butanamide CAS Name: N-(3-methylbutyl)-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-(3-methylbutyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxobutanamide Traditional Name: N-isoamyl-4-keto-4-(4-tosylpiperazino)butyramide Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O4S/c1-16(2)10-11-21-19(24)8-9-20(25)22-12-14-23(15-13-22)28(26,27)18-6-4-17(3)5-7-18/h4-7,16H,8-15H2,1-3H3,(H,21,24)