4-[2-butoxy-3-(hydroxymethyl)-6-(4-methylsulfanylphenyl)pyridin-4-yl]benzenesulfonamide

Systemtic Name: 4-[2-butoxy-3-(hydroxymethyl)-6-(4-methylsulfanylphenyl)pyridin-4-yl]benzenesulfonamide Openeye Name: 4-[2-butoxy-3-(hydroxymethyl)-6-(4-methylsulfanylphenyl)-4-pyridyl]benzenesulfonamide CAS Name: 4-[2-butoxy-3-(hydroxymethyl)-6-[4-(methylthio)phenyl]-4-pyridinyl]benzenesulfonamide IUPAC Name: 4-[2-butoxy-3-(hydroxymethyl)-6-(4-methylsulfanylphenyl)pyridin-4-yl]benzenesulfonamide Traditional Name: 4-[2-butoxy-3-methylol-6-[4-(methylthio)phenyl]-4-pyridyl]benzenesulfonamide Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=CC(=N1)C2=CC=C(C=C2)SC)C3=CC=C(C=C3)S(=O)(=O)N)CO

Isomeric SMILES

CCCCOC1=C(C(=CC(=N1)C2=CC=C(C=C2)SC)C3=CC=C(C=C3)S(=O)(=O)N)CO

InChI

InChI=1S/C23H26N2O4S2/c1-3-4-13-29-23-21(15-26)20(16-7-11-19(12-8-16)31(24,27)28)14-22(25-23)17-5-9-18(30-2)10-6-17/h5-12,14,26H,3-4,13,15H2,1-2H3,(H2,24,27,28)