N-(2,6-dimethoxypyrimidin-4-yl)-4-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide

Systemtic Name: N-(2,6-dimethoxypyrimidin-4-yl)-4-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide Openeye Name: N-(2,6-dimethoxypyrimidin-4-yl)-4-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide CAS Name: N-(2,6-dimethoxy-4-pyrimidinyl)-4-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzenesulfonamide IUPAC Name: N-(2,6-dimethoxypyrimidin-4-yl)-4-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide Traditional Name: N-(2,6-dimethoxypyrimidin-4-yl)-4-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide Formula: C19H17N5O7S MolecularWeight: 459.43258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C=C(C=CC3=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C=C(C=CC3=O)[N+](=O)[O-])OC

InChI

InChI=1S/C19H17N5O7S/c1-30-18-10-17(21-19(22-18)31-2)23-32(28,29)15-6-3-13(4-7-15)20-11-12-9-14(24(26)27)5-8-16(12)25/h3-11,20H,1-2H3,(H,21,22,23)