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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN=C1C)NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SN=C1C)NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

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