N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-quinolin-2-ylsulfanyl-butanamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-quinolin-2-ylsulfanyl-butanamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(2-quinolylsulfanyl)butanamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(2-quinolinylthio)butanamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-quinolin-2-ylsulfanylbutanamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(2-quinolylthio)butyramide Formula: C20H16ClF3N2OS MolecularWeight: 424.86705

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H16ClF3N2OS/c1-2-17(28-18-10-7-12-5-3-4-6-15(12)25-18)19(27)26-16-11-13(20(22,23)24)8-9-14(16)21/h3-11,17H,2H2,1H3,(H,26,27)