[2-butoxy-6-(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)pyridin-3-yl]methanol

Systemtic Name: [2-butoxy-6-(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)pyridin-3-yl]methanol Openeye Name: [2-butoxy-6-(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)-3-pyridyl]methanol CAS Name: [2-butoxy-5-(4-methylsulfonylphenyl)-6-[4-(methylthio)phenyl]-3-pyridinyl]methanol IUPAC Name: [2-butoxy-6-(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)pyridin-3-yl]methanol Traditional Name: [2-butoxy-5-(4-mesylphenyl)-6-[4-(methylthio)phenyl]-3-pyridyl]methanol Formula: C24H27NO4S2 MolecularWeight: 457.60548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27NO4S2/c1-4-5-14-29-24-19(16-26)15-22(17-8-12-21(13-9-17)31(3,27)28)23(25-24)18-6-10-20(30-2)11-7-18/h6-13,15,26H,4-5,14,16H2,1-3H3