5-chloranyl-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-2-(phenylmethylsulfanyl)benzenesulfonamide

Systemtic Name: 5-chloranyl-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-2-(phenylmethylsulfanyl)benzenesulfonamide Openeye Name: 2-benzylsulfanyl-5-chloro-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-benzenesulfonamide CAS Name: 5-chloro-N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]-3-methyl-2-(phenylmethylthio)benzenesulfonamide IUPAC Name: 2-benzylsulfanyl-5-chloro-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methylbenzenesulfonamide Traditional Name: 2-(benzylthio)-5-chloro-N-[4-methoxy-3-(4-methylpiperazino)phenyl]-3-methyl-benzenesulfonamide Formula: C26H30ClN3O3S2 MolecularWeight: 532.1177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1SCC2=CC=CC=C2)S(=O)(=O)NC3=CC(=C(C=C3)OC)N4CCN(CC4)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1SCC2=CC=CC=C2)S(=O)(=O)NC3=CC(=C(C=C3)OC)N4CCN(CC4)C)Cl

InChI

InChI=1S/C26H30ClN3O3S2/c1-19-15-21(27)16-25(26(19)34-18-20-7-5-4-6-8-20)35(31,32)28-22-9-10-24(33-3)23(17-22)30-13-11-29(2)12-14-30/h4-10,15-17,28H,11-14,18H2,1-3H3