methyl 3-[2-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[2-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylate Traditional Name: 3-[2-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylic acid methyl ester Formula: C11H12N4O3S MolecularWeight: 280.30298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(SC=C1)C(=O)OC)N2C=NC=N2

Isomeric SMILES

CC(C(=O)NC1=C(SC=C1)C(=O)OC)N2C=NC=N2

InChI

InChI=1S/C11H12N4O3S/c1-7(15-6-12-5-13-15)10(16)14-8-3-4-19-9(8)11(17)18-2/h3-7H,1-2H3,(H,14,16)