N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-4-[(4-methylphenyl)amino]-3,5-dinitro-benzamide

Systemtic Name: N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-4-[(4-methylphenyl)amino]-3,5-dinitro-benzamide Openeye Name: N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-4-(4-methylanilino)-3,5-dinitro-benzamide CAS Name: N-[4-[(6-methoxy-3-pyridazinyl)sulfamoyl]phenyl]-4-(4-methylanilino)-3,5-dinitrobenzamide IUPAC Name: N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-4-(4-methylanilino)-3,5-dinitrobenzamide Traditional Name: N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-4-(p-toluidino)benzamide Formula: C25H21N7O8S MolecularWeight: 579.54134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NN=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NN=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H21N7O8S/c1-15-3-5-17(6-4-15)26-24-20(31(34)35)13-16(14-21(24)32(36)37)25(33)27-18-7-9-19(10-8-18)41(38,39)30-22-11-12-23(40-2)29-28-22/h3-14,26H,1-2H3,(H,27,33)(H,28,30)