2-(4-bromophenyl)-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide

Systemtic Name: 2-(4-bromophenyl)-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-[3-(methylthio)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-[3-(methylthio)phenyl]cinchoninamide Formula: C23H17BrN2OS MolecularWeight: 449.36288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H17BrN2OS/c1-28-18-6-4-5-17(13-18)25-23(27)20-14-22(15-9-11-16(24)12-10-15)26-21-8-3-2-7-19(20)21/h2-14H,1H3,(H,25,27)