propan-2-yl 4-[(4,6,8-trimethylquinolin-2-yl)sulfanylmethyl]benzoate

Systemtic Name: propan-2-yl 4-[(4,6,8-trimethylquinolin-2-yl)sulfanylmethyl]benzoate Openeye Name: isopropyl 4-[(4,6,8-trimethyl-2-quinolyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4,6,8-trimethyl-2-quinolinyl)thio]methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(4,6,8-trimethylquinolin-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4,6,8-trimethyl-2-quinolyl)thio]methyl]benzoic acid isopropyl ester Formula: C23H25NO2S MolecularWeight: 379.5151

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC3=CC=C(C=C3)C(=O)OC(C)C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC3=CC=C(C=C3)C(=O)OC(C)C)C)C

InChI

InChI=1S/C23H25NO2S/c1-14(2)26-23(25)19-8-6-18(7-9-19)13-27-21-12-16(4)20-11-15(3)10-17(5)22(20)24-21/h6-12,14H,13H2,1-5H3