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

Systemtic Name: methyl 5-[[1-(phenylmethyl)-1,2,3-triazol-4-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 5-[(1-benzyltriazole-4-carbonyl)amino]thiophene-2-carboxylate CAS Name: 5-[[oxo-[1-(phenylmethyl)-4-triazolyl]methyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(1-benzyltriazole-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-[(1-benzyltriazole-4-carbonyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C16H14N4O3S MolecularWeight: 342.37236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(S1)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

InChI

InChI=1S/C16H14N4O3S/c1-23-16(22)13-7-8-14(24-13)17-15(21)12-10-20(19-18-12)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,17,21)