methyl 4,5-dimethyl-2-[2-(1,2,4-triazol-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-(1,2,4-triazol-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C=NC=N2)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C=NC=N2)C

InChI

InChI=1S/C12H14N4O3S/c1-7-8(2)20-11(10(7)12(18)19-3)15-9(17)4-16-6-13-5-14-16/h5-6H,4H2,1-3H3,(H,15,17)