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

Systemtic Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3,5-dinitro-4-phenylazanyl-benzamide Openeye Name: 4-anilino-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3,5-dinitro-benzamide CAS Name: 4-anilino-N-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: 4-anilino-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3,5-dinitrobenzamide Traditional Name: 4-anilino-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3,5-dinitro-benzamide Formula: C25H21N7O7S MolecularWeight: 563.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)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-])C

Isomeric SMILES

CC1=CC(=NC(=N1)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-])C

InChI

InChI=1S/C25H21N7O7S/c1-15-12-16(2)27-25(26-15)30-40(38,39)20-10-8-19(9-11-20)29-24(33)17-13-21(31(34)35)23(22(14-17)32(36)37)28-18-6-4-3-5-7-18/h3-14,28H,1-2H3,(H,29,33)(H,26,27,30)