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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2C=NC=N2)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2C=NC=N2)C

InChI

InChI=1S/C12H14N4O3S/c1-3-19-12(18)11-8(2)4-10(20-11)15-9(17)5-16-7-13-6-14-16/h4,6-7H,3,5H2,1-2H3,(H,15,17)