[(3S)-2-oxidanylideneoxolan-3-yl] 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 2-(p-tolylsulfanyl)pyridine-3-carboxylate CAS Name: 2-[(4-methylphenyl)thio]-3-pyridinecarboxylic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-(p-tolylthio)nicotinic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C17H15NO4S MolecularWeight: 329.3703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)OC3CCOC3=O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)O[C@H]3CCOC3=O

InChI

InChI=1S/C17H15NO4S/c1-11-4-6-12(7-5-11)23-15-13(3-2-9-18-15)16(19)22-14-8-10-21-17(14)20/h2-7,9,14H,8,10H2,1H3/t14-/m0/s1