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

Systemtic Name: N-(4-methyl-3-nitro-phenyl)sulfonyl-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)pyridine-3-carboxamide Openeye Name: N-(4-methyl-3-nitro-phenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pyridine-3-carboxamide CAS Name: N-(4-methyl-3-nitrophenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)-3-pyridinecarboxamide IUPAC Name: N-(4-methyl-3-nitrophenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pyridine-3-carboxamide Traditional Name: N-(2-keto-1,3-benzoxathiol-5-yl)-N-(4-methyl-3-nitro-phenyl)sulfonyl-nicotinamide Formula: C20H13N3O7S2 MolecularWeight: 471.46312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13N3O7S2/c1-12-4-6-15(10-16(12)23(26)27)32(28,29)22(19(24)13-3-2-8-21-11-13)14-5-7-17-18(9-14)31-20(25)30-17/h2-11H,1H3