ethyl 4-methyl-2-[[4-[[4-[(4-methylphenyl)amino]-3,5-dinitro-phenyl]carbonylamino]phenyl]sulfonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[4-[[4-[(4-methylphenyl)amino]-3,5-dinitro-phenyl]carbonylamino]phenyl]sulfonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[4-[[4-(4-methylanilino)-3,5-dinitro-benzoyl]amino]phenyl]sulfonylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[4-[[[4-(4-methylanilino)-3,5-dinitrophenyl]-oxomethyl]amino]phenyl]sulfonylamino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[4-[[4-(4-methylanilino)-3,5-dinitrobenzoyl]amino]phenyl]sulfonylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[4-[[3,5-dinitro-4-(p-toluidino)benzoyl]amino]phenyl]sulfonylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C27H24N6O9S2 MolecularWeight: 640.64426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])NC4=CC=C(C=C4)C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])NC4=CC=C(C=C4)C)[N+](=O)[O-])C

InChI

InChI=1S/C27H24N6O9S2/c1-4-42-26(35)24-16(3)28-27(43-24)31-44(40,41)20-11-9-19(10-12-20)30-25(34)17-13-21(32(36)37)23(22(14-17)33(38)39)29-18-7-5-15(2)6-8-18/h5-14,29H,4H2,1-3H3,(H,28,31)(H,30,34)