N-(4-methylphenyl)sulfonyl-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)pyridine-3-carboxamide

Systemtic Name: N-(4-methylphenyl)sulfonyl-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)pyridine-3-carboxamide Openeye Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(p-tolylsulfonyl)pyridine-3-carboxamide CAS Name: N-(4-methylphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)-3-pyridinecarboxamide IUPAC Name: N-(4-methylphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pyridine-3-carboxamide Traditional Name: N-(2-keto-1,3-benzoxathiol-5-yl)-N-tosyl-nicotinamide Formula: C20H14N2O5S2 MolecularWeight: 426.46556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=O)S3)C(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=O)S3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H14N2O5S2/c1-13-4-7-16(8-5-13)29(25,26)22(19(23)14-3-2-10-21-12-14)15-6-9-17-18(11-15)28-20(24)27-17/h2-12H,1H3