2-(2-chlorophenyl)sulfanyl-N-(3-ethoxypropyl)quinoline-4-carboxamide

Systemtic Name: 2-(2-chlorophenyl)sulfanyl-N-(3-ethoxypropyl)quinoline-4-carboxamide Openeye Name: 2-(2-chlorophenyl)sulfanyl-N-(3-ethoxypropyl)quinoline-4-carboxamide CAS Name: 2-[(2-chlorophenyl)thio]-N-(3-ethoxypropyl)-4-quinolinecarboxamide IUPAC Name: 2-(2-chlorophenyl)sulfanyl-N-(3-ethoxypropyl)quinoline-4-carboxamide Traditional Name: 2-[(2-chlorophenyl)thio]-N-(3-ethoxypropyl)cinchoninamide Formula: C21H21ClN2O2S MolecularWeight: 400.92164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC=CC=C3Cl

Isomeric SMILES

CCOCCCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC=CC=C3Cl

InChI

InChI=1S/C21H21ClN2O2S/c1-2-26-13-7-12-23-21(25)16-14-20(24-18-10-5-3-8-15(16)18)27-19-11-6-4-9-17(19)22/h3-6,8-11,14H,2,7,12-13H2,1H3,(H,23,25)