2-[3-(phenylmethyl)quinolin-2-yl]sulfanyl-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[3-(phenylmethyl)quinolin-2-yl]sulfanyl-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(3-benzyl-2-quinolyl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[3-(phenylmethyl)-2-quinolinyl]thio]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(3-benzylquinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(3-benzyl-2-quinolyl)thio]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C25H19F3N2OS MolecularWeight: 452.49137

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C25H19F3N2OS/c26-25(27,28)20-11-5-7-13-22(20)29-23(31)16-32-24-19(14-17-8-2-1-3-9-17)15-18-10-4-6-12-21(18)30-24/h1-13,15H,14,16H2,(H,29,31)