2-[6-chloranyl-2-[(4,6,8-trimethylquinolin-2-yl)sulfanylmethyl]benzimidazol-1-yl]ethanol

Systemtic Name: 2-[6-chloranyl-2-[(4,6,8-trimethylquinolin-2-yl)sulfanylmethyl]benzimidazol-1-yl]ethanol Openeye Name: 2-[6-chloro-2-[(4,6,8-trimethyl-2-quinolyl)sulfanylmethyl]benzimidazol-1-yl]ethanol CAS Name: 2-[6-chloro-2-[[(4,6,8-trimethyl-2-quinolinyl)thio]methyl]-1-benzimidazolyl]ethanol IUPAC Name: 2-[6-chloro-2-[(4,6,8-trimethylquinolin-2-yl)sulfanylmethyl]benzimidazol-1-yl]ethanol Traditional Name: 2-[6-chloro-2-[[(4,6,8-trimethyl-2-quinolyl)thio]methyl]benzimidazol-1-yl]ethanol Formula: C22H22ClN3OS MolecularWeight: 411.94758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC3=NC4=C(N3CCO)C=C(C=C4)Cl)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC3=NC4=C(N3CCO)C=C(C=C4)Cl)C)C

InChI

InChI=1S/C22H22ClN3OS/c1-13-8-15(3)22-17(9-13)14(2)10-21(25-22)28-12-20-24-18-5-4-16(23)11-19(18)26(20)6-7-27/h4-5,8-11,27H,6-7,12H2,1-3H3