2-(3-chlorophenyl)sulfanyl-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(3-chlorophenyl)sulfanyl-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(3-chlorophenyl)sulfanyl-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide CAS Name: 2-[(3-chlorophenyl)thio]-N-[(4-fluorophenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(3-chlorophenyl)sulfanyl-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-[(3-chlorophenyl)thio]-N-(4-fluorobenzyl)cinchoninamide Formula: C23H16ClFN2OS MolecularWeight: 422.902343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)SC3=CC(=CC=C3)Cl)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)SC3=CC(=CC=C3)Cl)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C23H16ClFN2OS/c24-16-4-3-5-18(12-16)29-22-13-20(19-6-1-2-7-21(19)27-22)23(28)26-14-15-8-10-17(25)11-9-15/h1-13H,14H2,(H,26,28)