4-methoxy-N-(2-methylsulfanylphenyl)-3-piperazin-1-yl-benzenesulfonamide

Systemtic Name: 4-methoxy-N-(2-methylsulfanylphenyl)-3-piperazin-1-yl-benzenesulfonamide Openeye Name: 4-methoxy-N-(2-methylsulfanylphenyl)-3-piperazin-1-yl-benzenesulfonamide CAS Name: 4-methoxy-N-[2-(methylthio)phenyl]-3-(1-piperazinyl)benzenesulfonamide IUPAC Name: 4-methoxy-N-(2-methylsulfanylphenyl)-3-piperazin-1-ylbenzenesulfonamide Traditional Name: 4-methoxy-N-[2-(methylthio)phenyl]-3-piperazino-benzenesulfonamide Formula: C18H23N3O3S2 MolecularWeight: 393.52352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2SC)N3CCNCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2SC)N3CCNCC3

InChI

InChI=1S/C18H23N3O3S2/c1-24-17-8-7-14(13-16(17)21-11-9-19-10-12-21)26(22,23)20-15-5-3-4-6-18(15)25-2/h3-8,13,19-20H,9-12H2,1-2H3