N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-(4-methylphenyl)-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-(4-methylphenyl)-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-4-methylsulfanyl-N-(p-tolyl)benzenesulfonamide CAS Name: N-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-N-(4-methylphenyl)-4-(methylthio)benzenesulfonamide IUPAC Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-N-(4-methylphenyl)-4-methylsulfanylbenzenesulfonamide Traditional Name: N-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]-4-(methylthio)-N-(p-tolyl)benzenesulfonamide Formula: C26H28FN3O3S2 MolecularWeight: 513.647223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C26H28FN3O3S2/c1-20-3-7-23(8-4-20)30(35(32,33)25-13-11-24(34-2)12-14-25)19-26(31)29-17-15-28(16-18-29)22-9-5-21(27)6-10-22/h3-14H,15-19H2,1-2H3