[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C16H12ClN3O3S MolecularWeight: 361.80278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3Cl

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H12ClN3O3S/c1-24-15-11(6-4-8-18-15)16(21)22-9-13-19-14(20-23-13)10-5-2-3-7-12(10)17/h2-8H,9H2,1H3