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

Systemtic Name: ethyl 4-methyl-2-[(5-nitrothiophen-2-yl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[(5-nitrothiophene-2-carbonyl)amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[(5-nitro-2-thiophenyl)-oxomethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(5-nitrothiophene-2-carbonyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[(5-nitrothiophene-2-carbonyl)amino]thiazole-5-carboxylic acid ethyl ester Formula: C12H11N3O5S2 MolecularWeight: 341.36284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC=C(S2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC=C(S2)[N+](=O)[O-])C

InChI

InChI=1S/C12H11N3O5S2/c1-3-20-11(17)9-6(2)13-12(22-9)14-10(16)7-4-5-8(21-7)15(18)19/h4-5H,3H2,1-2H3,(H,13,14,16)