4-[(7-chloranyl-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide

Systemtic Name: 4-[(7-chloranyl-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide Openeye Name: 4-[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide CAS Name: 4-[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-N-(2,6-dimethoxy-4-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide Traditional Name: 4-[(7-chloro-4-nitro-benzofurazan-5-yl)amino]-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide Formula: C18H14ClN7O7S MolecularWeight: 507.86446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=C(C4=NON=C4C(=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=C(C4=NON=C4C(=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C18H14ClN7O7S/c1-31-14-8-13(21-18(22-14)32-2)25-34(29,30)10-5-3-9(4-6-10)20-12-7-11(19)15-16(24-33-23-15)17(12)26(27)28/h3-8,20H,1-2H3,(H,21,22,25)