2-(3-chlorophenyl)sulfanyl-N-[2-[ethyl(phenyl)amino]ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(3-chlorophenyl)sulfanyl-N-[2-[ethyl(phenyl)amino]ethyl]quinoline-4-carboxamide Openeye Name: 2-(3-chlorophenyl)sulfanyl-N-[2-(N-ethylanilino)ethyl]quinoline-4-carboxamide CAS Name: 2-[(3-chlorophenyl)thio]-N-[2-(N-ethylanilino)ethyl]-4-quinolinecarboxamide IUPAC Name: 2-(3-chlorophenyl)sulfanyl-N-[2-(N-ethylanilino)ethyl]quinoline-4-carboxamide Traditional Name: 2-[(3-chlorophenyl)thio]-N-[2-(N-ethylanilino)ethyl]cinchoninamide Formula: C26H24ClN3OS MolecularWeight: 462.00626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC(=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCN(CCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC(=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H24ClN3OS/c1-2-30(20-10-4-3-5-11-20)16-15-28-26(31)23-18-25(29-24-14-7-6-13-22(23)24)32-21-12-8-9-19(27)17-21/h3-14,17-18H,2,15-16H2,1H3,(H,28,31)