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

Systemtic Name: ethyl 5-[(3,5-dinitrophenyl)carbonylamino]-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: ethyl 5-[(3,5-dinitrobenzoyl)amino]-3-methyl-isothiazole-4-carboxylate CAS Name: 5-[[(3,5-dinitrophenyl)-oxomethyl]amino]-3-methyl-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3,5-dinitrobenzoyl)amino]-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-[(3,5-dinitrobenzoyl)amino]-3-methyl-isothiazole-4-carboxylic acid ethyl ester Formula: C14H12N4O7S MolecularWeight: 380.33268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N4O7S/c1-3-25-14(20)11-7(2)16-26-13(11)15-12(19)8-4-9(17(21)22)6-10(5-8)18(23)24/h4-6H,3H2,1-2H3,(H,15,19)