methyl 5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C10H11N3O3S MolecularWeight: 253.27764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=CC=C(O2)C(=O)OC

Isomeric SMILES

CN1C=NN=C1SCC2=CC=C(O2)C(=O)OC

InChI

InChI=1S/C10H11N3O3S/c1-13-6-11-12-10(13)17-5-7-3-4-8(16-7)9(14)15-2/h3-4,6H,5H2,1-2H3