N-(4-bromophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[(4,6,8-trimethyl-2-quinolyl)thio]acetamide Formula: C20H19BrN2OS MolecularWeight: 415.34666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)NC3=CC=C(C=C3)Br)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)NC3=CC=C(C=C3)Br)C)C

InChI

InChI=1S/C20H19BrN2OS/c1-12-8-14(3)20-17(9-12)13(2)10-19(23-20)25-11-18(24)22-16-6-4-15(21)5-7-16/h4-10H,11H2,1-3H3,(H,22,24)