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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCC1=C(SC(=N1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OCC

InChI

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