N-[cyclopropyl-(4-methylphenyl)methyl]-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-[cyclopropyl-(4-methylphenyl)methyl]-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-[cyclopropyl(p-tolyl)methyl]-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxo-butanamide CAS Name: N-[cyclopropyl-(4-methylphenyl)methyl]-4-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-[cyclopropyl-(4-methylphenyl)methyl]-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxobutanamide Traditional Name: N-[cyclopropyl(p-tolyl)methyl]-4-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-4-keto-butyramide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CC2)NC(=O)CCC(=O)N3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2CC2)NC(=O)CCC(=O)N3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C27H35N3O4S/c1-19-5-8-22(9-6-19)27(23-10-11-23)28-25(31)12-13-26(32)29-14-16-30(17-15-29)35(33,34)24-18-20(2)4-7-21(24)3/h4-9,18,23,27H,10-17H2,1-3H3,(H,28,31)