methyl 2-sulfanylidene-3,5-dihydrobenzimidazole-5-carboxylate

Systemtic Name: methyl 2-sulfanylidene-3,5-dihydrobenzimidazole-5-carboxylate Openeye Name: methyl 2-thioxo-3,5-dihydrobenzimidazole-5-carboxylate CAS Name: 2-sulfanylidene-3,5-dihydrobenzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-sulfanylidene-3,5-dihydrobenzimidazole-5-carboxylate Traditional Name: 2-thioxo-3,5-dihydrobenzimidazole-5-carboxylic acid methyl ester Formula: C9H8N2O2S MolecularWeight: 208.23702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C=CC2=NC(=S)NC2=C1

Isomeric SMILES

COC(=O)C1C=CC2=NC(=S)NC2=C1

InChI

InChI=1S/C9H8N2O2S/c1-13-8(12)5-2-3-6-7(4-5)11-9(14)10-6/h2-5H,1H3,(H,11,14)