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

Systemtic Name: ethyl 4-[(3,5-dinitrophenyl)carbonylamino]-3-ethyl-2-sulfanylidene-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-[(3,5-dinitrobenzoyl)amino]-3-ethyl-2-thioxo-thiazole-5-carboxylate CAS Name: 4-[[(3,5-dinitrophenyl)-oxomethyl]amino]-3-ethyl-2-sulfanylidene-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3,5-dinitrobenzoyl)amino]-3-ethyl-2-sulfanylidene-1,3-thiazole-5-carboxylate Traditional Name: 4-[(3,5-dinitrobenzoyl)amino]-3-ethyl-2-thioxo-4-thiazoline-5-carboxylic acid ethyl ester Formula: C15H14N4O7S2 MolecularWeight: 426.42426

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(SC1=S)C(=O)OCC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN1C(=C(SC1=S)C(=O)OCC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O7S2/c1-3-17-12(11(28-15(17)27)14(21)26-4-2)16-13(20)8-5-9(18(22)23)7-10(6-8)19(24)25/h5-7H,3-4H2,1-2H3,(H,16,20)