N-(4-bromanyl-2-chloranyl-phenyl)-6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-6,8-dimethyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(4-bromo-2-chlorophenyl)-6,8-dimethyl-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-6,8-dimethyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-6,8-dimethyl-2-(2-thienyl)cinchoninamide Formula: C22H16BrClN2OS MolecularWeight: 471.79724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=C(C=C4)Br)Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=C(C=C4)Br)Cl)C

InChI

InChI=1S/C22H16BrClN2OS/c1-12-8-13(2)21-15(9-12)16(11-19(25-21)20-4-3-7-28-20)22(27)26-18-6-5-14(23)10-17(18)24/h3-11H,1-2H3,(H,26,27)