N-(2,4-dimethoxyphenyl)-2-[3-(phenylmethyl)quinolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-[3-(phenylmethyl)quinolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[(3-benzyl-2-quinolyl)sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide CAS Name: N-(2,4-dimethoxyphenyl)-2-[[3-(phenylmethyl)-2-quinolinyl]thio]acetamide IUPAC Name: 2-(3-benzylquinolin-2-yl)sulfanyl-N-(2,4-dimethoxyphenyl)acetamide Traditional Name: 2-[(3-benzyl-2-quinolyl)thio]-N-(2,4-dimethoxyphenyl)acetamide Formula: C26H24N2O3S MolecularWeight: 444.54536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2CC4=CC=CC=C4)OC

InChI

InChI=1S/C26H24N2O3S/c1-30-21-12-13-23(24(16-21)31-2)27-25(29)17-32-26-20(14-18-8-4-3-5-9-18)15-19-10-6-7-11-22(19)28-26/h3-13,15-16H,14,17H2,1-2H3,(H,27,29)