N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[2-(1-pyrrolidinyl)-4-(trifluoromethyl)phenyl]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-[2-pyrrolidino-4-(trifluoromethyl)phenyl]-2-(8-quinolylthio)acetamide Formula: C22H20F3N3OS MolecularWeight: 431.47391

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC(=C2)C(F)(F)F)NC(=O)CSC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCN(C1)C2=C(C=CC(=C2)C(F)(F)F)NC(=O)CSC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H20F3N3OS/c23-22(24,25)16-8-9-17(18(13-16)28-11-1-2-12-28)27-20(29)14-30-19-7-3-5-15-6-4-10-26-21(15)19/h3-10,13H,1-2,11-12,14H2,(H,27,29)