N-[3-[2-cyclohexyl-3-oxidanylidene-4-(phenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-[2-cyclohexyl-3-oxidanylidene-4-(phenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-(4-benzyl-2-cyclohexyl-3-oxo-piperazin-1-yl)-3-oxo-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-[2-cyclohexyl-3-oxo-4-(phenylmethyl)-1-piperazinyl]-3-oxopropyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(4-benzyl-2-cyclohexyl-3-oxopiperazin-1-yl)-3-oxopropyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-(4-benzyl-2-cyclohexyl-3-keto-piperazino)-3-keto-propyl]-4-methyl-benzenesulfonamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N2CCN(C(=O)C2C3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N2CCN(C(=O)C2C3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H35N3O4S/c1-21-12-14-24(15-13-21)35(33,34)28-17-16-25(31)30-19-18-29(20-22-8-4-2-5-9-22)27(32)26(30)23-10-6-3-7-11-23/h2,4-5,8-9,12-15,23,26,28H,3,6-7,10-11,16-20H2,1H3