ethyl 4-cyano-3-methyl-5-[(4-methyl-1,2,3-thiadiazol-5-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-5-[(4-methyl-1,2,3-thiadiazol-5-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-5-[(4-methylthiadiazole-5-carbonyl)amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[(4-methyl-5-thiadiazolyl)-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-[(4-methylthiadiazole-5-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[(4-methylthiadiazole-5-carbonyl)amino]thiophene-2-carboxylic acid ethyl ester Formula: C13H12N4O3S2 MolecularWeight: 336.38938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=C(N=NS2)C)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=C(N=NS2)C)C#N)C

InChI

InChI=1S/C13H12N4O3S2/c1-4-20-13(19)9-6(2)8(5-14)12(21-9)15-11(18)10-7(3)16-17-22-10/h4H2,1-3H3,(H,15,18)