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

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-(4-ethylphenyl)sulfanyl-quinoline-4-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-(4-ethylphenyl)sulfanyl-quinoline-4-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[(4-ethylphenyl)thio]-4-quinolinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-(4-ethylphenyl)sulfanylquinoline-4-carboxamide Traditional Name: N-(2-chlorobenzyl)-2-[(4-ethylphenyl)thio]cinchoninamide Formula: C25H21ClN2OS MolecularWeight: 432.96504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

CCC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C25H21ClN2OS/c1-2-17-11-13-19(14-12-17)30-24-15-21(20-8-4-6-10-23(20)28-24)25(29)27-16-18-7-3-5-9-22(18)26/h3-15H,2,16H2,1H3,(H,27,29)