(E)-N-cyclopentyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-but-2-enamide

Systemtic Name: (E)-N-cyclopentyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-but-2-enamide Openeye Name: (E)-N-cyclopentyl-4-oxo-4-[4-(p-tolylsulfonyl)piperazin-1-yl]but-2-enamide CAS Name: (E)-N-cyclopentyl-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-oxo-2-butenamide IUPAC Name: (E)-N-cyclopentyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxobut-2-enamide Traditional Name: (E)-N-cyclopentyl-4-keto-4-(4-tosylpiperazino)but-2-enamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C=CC(=O)NC3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)/C=C/C(=O)NC3CCCC3

InChI

InChI=1S/C20H27N3O4S/c1-16-6-8-18(9-7-16)28(26,27)23-14-12-22(13-15-23)20(25)11-10-19(24)21-17-4-2-3-5-17/h6-11,17H,2-5,12-15H2,1H3,(H,21,24)/b11-10+