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

Systemtic Name: N-[5-cyano-2-[4-(hydroxymethyl)phenyl]-6-methoxy-pyridin-3-yl]benzenesulfonamide Openeye Name: N-[5-cyano-2-[4-(hydroxymethyl)phenyl]-6-methoxy-3-pyridyl]benzenesulfonamide CAS Name: N-[5-cyano-2-[4-(hydroxymethyl)phenyl]-6-methoxy-3-pyridinyl]benzenesulfonamide IUPAC Name: N-[5-cyano-2-[4-(hydroxymethyl)phenyl]-6-methoxypyridin-3-yl]benzenesulfonamide Traditional Name: N-[5-cyano-6-methoxy-2-(4-methylolphenyl)-3-pyridyl]benzenesulfonamide Formula: C20H17N3O4S MolecularWeight: 395.43168

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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)CO

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O4S/c1-27-20-16(12-21)11-18(23-28(25,26)17-5-3-2-4-6-17)19(22-20)15-9-7-14(13-24)8-10-15/h2-11,23-24H,13H2,1H3