N-[5-cyano-6-methoxy-2-(4-methylsulfanylphenyl)pyridin-3-yl]benzenesulfonamide

Systemtic Name: N-[5-cyano-6-methoxy-2-(4-methylsulfanylphenyl)pyridin-3-yl]benzenesulfonamide Openeye Name: N-[5-cyano-6-methoxy-2-(4-methylsulfanylphenyl)-3-pyridyl]benzenesulfonamide CAS Name: N-[5-cyano-6-methoxy-2-[4-(methylthio)phenyl]-3-pyridinyl]benzenesulfonamide IUPAC Name: N-[5-cyano-6-methoxy-2-(4-methylsulfanylphenyl)pyridin-3-yl]benzenesulfonamide Traditional Name: N-[5-cyano-6-methoxy-2-[4-(methylthio)phenyl]-3-pyridyl]benzenesulfonamide Formula: C20H17N3O3S2 MolecularWeight: 411.49728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1C#N)NS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)SC

Isomeric SMILES

COC1=NC(=C(C=C1C#N)NS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H17N3O3S2/c1-26-20-15(13-21)12-18(23-28(24,25)17-6-4-3-5-7-17)19(22-20)14-8-10-16(27-2)11-9-14/h3-12,23H,1-2H3