N-phenethyl-2-[2-(trifluoromethyl)phenyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-phenethyl-2-[2-(trifluoromethyl)phenyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-phenethyl-2-[2-(trifluoromethyl)phenyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-phenethyl-2-[[2-(trifluoromethyl)phenyl]thio]-4-quinolinecarboxamide IUPAC Name: N-phenethyl-2-[2-(trifluoromethyl)phenyl]sulfanylquinoline-4-carboxamide Traditional Name: N-phenethyl-2-[[2-(trifluoromethyl)phenyl]thio]cinchoninamide Formula: C25H19F3N2OS MolecularWeight: 452.49137

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=CC=C4C(F)(F)F

InChI

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