O5-(2-hydroxyethyl) O3-propan-2-yl 2,6-dimethyl-4-(2-methylsulfanylpyridin-3-yl)pyridine-3,5-dicarboxylate

Systemtic Name: O5-(2-hydroxyethyl) O3-propan-2-yl 2,6-dimethyl-4-(2-methylsulfanylpyridin-3-yl)pyridine-3,5-dicarboxylate Openeye Name: O5-(2-hydroxyethyl) O3-isopropyl 2,6-dimethyl-4-(2-methylsulfanyl-3-pyridyl)pyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[2-(methylthio)-3-pyridinyl]pyridine-3,5-dicarboxylic acid O5-(2-hydroxyethyl) ester O3-propan-2-yl ester IUPAC Name: 5-O-(2-hydroxyethyl) 3-O-propan-2-yl 2,6-dimethyl-4-(2-methylsulfanylpyridin-3-yl)pyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-[2-(methylthio)-3-pyridyl]pyridine-3,5-dicarboxylic acid O5-(2-hydroxyethyl) ester O3-isopropyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C)C(=O)OCCO)C2=C(N=CC=C2)SC)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(=C(C(=N1)C)C(=O)OCCO)C2=C(N=CC=C2)SC)C(=O)OC(C)C

InChI

InChI=1S/C20H24N2O5S/c1-11(2)27-20(25)16-13(4)22-12(3)15(19(24)26-10-9-23)17(16)14-7-6-8-21-18(14)28-5/h6-8,11,23H,9-10H2,1-5H3