N-(5-methoxy-2-methylsulfanyl-pyrimidin-4-yl)benzenesulfonamide

Systemtic Name: N-(5-methoxy-2-methylsulfanyl-pyrimidin-4-yl)benzenesulfonamide Openeye Name: N-(5-methoxy-2-methylsulfanyl-pyrimidin-4-yl)benzenesulfonamide CAS Name: N-[5-methoxy-2-(methylthio)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: N-(5-methoxy-2-methylsulfanylpyrimidin-4-yl)benzenesulfonamide Traditional Name: N-[5-methoxy-2-(methylthio)pyrimidin-4-yl]benzenesulfonamide Formula: C12H13N3O3S2 MolecularWeight: 311.37992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=C(N=C1NS(=O)(=O)C2=CC=CC=C2)SC

Isomeric SMILES

COC1=CN=C(N=C1NS(=O)(=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C12H13N3O3S2/c1-18-10-8-13-12(19-2)14-11(10)15-20(16,17)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,13,14,15)