N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-(4-ethoxyphenyl)-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-(4-ethoxyphenyl)-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-N-(4-ethoxyphenyl)-4-methylsulfanyl-benzenesulfonamide CAS Name: N-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-N-(4-ethoxyphenyl)-4-(methylthio)benzenesulfonamide IUPAC Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-N-(4-ethoxyphenyl)-4-methylsulfanylbenzenesulfonamide Traditional Name: N-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-4-(methylthio)-N-p-phenetyl-benzenesulfonamide Formula: C27H30ClN3O4S2 MolecularWeight: 560.1278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C27H30ClN3O4S2/c1-3-35-24-9-7-22(8-10-24)31(37(33,34)26-13-11-25(36-2)12-14-26)20-27(32)30-17-15-29(16-18-30)23-6-4-5-21(28)19-23/h4-14,19H,3,15-18,20H2,1-2H3