methyl 3-[2-(1,2,3,4-tetrazol-1-yl)ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(1,2,3,4-tetrazol-1-yl)ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(tetrazol-1-yl)acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-(1-tetrazolyl)ethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(tetrazol-1-yl)acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-(tetrazol-1-yl)acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C9H9N5O3S MolecularWeight: 267.26446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CN2C=NN=N2

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CN2C=NN=N2

InChI

InChI=1S/C9H9N5O3S/c1-17-9(16)8-6(2-3-18-8)11-7(15)4-14-5-10-12-13-14/h2-3,5H,4H2,1H3,(H,11,15)