N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3,5-dinitro-4-phenylazanyl-benzamide

Systemtic Name: N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3,5-dinitro-4-phenylazanyl-benzamide Openeye Name: 4-anilino-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3,5-dinitro-benzamide CAS Name: 4-anilino-N-[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: 4-anilino-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3,5-dinitrobenzamide Traditional Name: 4-anilino-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3,5-dinitro-benzamide Formula: C25H21N7O9S MolecularWeight: 595.54074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])NC4=CC=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])NC4=CC=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H21N7O9S/c1-40-22-14-21(28-25(29-22)41-2)30-42(38,39)18-10-8-17(9-11-18)27-24(33)15-12-19(31(34)35)23(20(13-15)32(36)37)26-16-6-4-3-5-7-16/h3-14,26H,1-2H3,(H,27,33)(H,28,29,30)