ethyl 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furan-3-carboxylate

Systemtic Name: ethyl 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furan-3-carboxylate Openeye Name: ethyl 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]furan-3-carboxylic acid ethyl ester Formula: C16H14FN3O3S MolecularWeight: 347.364063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CSC2=NN=CN2C3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CSC2=NN=CN2C3=CC=CC=C3F

InChI

InChI=1S/C16H14FN3O3S/c1-2-22-15(21)11-7-8-23-14(11)9-24-16-19-18-10-20(16)13-6-4-3-5-12(13)17/h3-8,10H,2,9H2,1H3