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

Systemtic Name: methyl 2-[(3,5-dinitrophenyl)carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[(3,5-dinitrobenzoyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3,5-dinitrobenzoyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C13H10N4O7S MolecularWeight: 366.3061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H10N4O7S/c1-6-10(12(19)24-2)25-13(14-6)15-11(18)7-3-8(16(20)21)5-9(4-7)17(22)23/h3-5H,1-2H3,(H,14,15,18)