2-(4-propan-2-ylphenyl)sulfanylpyridine-4-carboxylate

Systemtic Name: 2-(4-propan-2-ylphenyl)sulfanylpyridine-4-carboxylate Openeye Name: 2-(4-isopropylphenyl)sulfanylpyridine-4-carboxylate CAS Name: 2-[(4-propan-2-ylphenyl)thio]-4-pyridinecarboxylate IUPAC Name: 2-(4-propan-2-ylphenyl)sulfanylpyridine-4-carboxylate Traditional Name: 2-(p-cumenylthio)isonicotinate Formula: C15H14NO2S- MolecularWeight: 272.34216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SC2=NC=CC(=C2)C(=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SC2=NC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C15H15NO2S/c1-10(2)11-3-5-13(6-4-11)19-14-9-12(15(17)18)7-8-16-14/h3-10H,1-2H3,(H,17,18)/p-1