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

Systemtic Name: ethyl 4-methyl-2-[(4-methyl-3,5-dinitro-phenyl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[(4-methyl-3,5-dinitro-benzoyl)amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[(4-methyl-3,5-dinitrophenyl)-oxomethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(4-methyl-3,5-dinitrobenzoyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[(4-methyl-3,5-dinitro-benzoyl)amino]thiazole-5-carboxylic acid ethyl ester Formula: C15H14N4O7S MolecularWeight: 394.35926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N4O7S/c1-4-26-14(21)12-8(3)16-15(27-12)17-13(20)9-5-10(18(22)23)7(2)11(6-9)19(24)25/h5-6H,4H2,1-3H3,(H,16,17,20)