2-(quinolin-4-ylmethylsulfanyl)-N-[4-(trifluoromethyloxy)phenyl]benzamide

Systemtic Name: 2-(quinolin-4-ylmethylsulfanyl)-N-[4-(trifluoromethyloxy)phenyl]benzamide Openeye Name: 2-(4-quinolylmethylsulfanyl)-N-[4-(trifluoromethoxy)phenyl]benzamide CAS Name: 2-(4-quinolinylmethylthio)-N-[4-(trifluoromethoxy)phenyl]benzamide IUPAC Name: 2-(quinolin-4-ylmethylsulfanyl)-N-[4-(trifluoromethoxy)phenyl]benzamide Traditional Name: 2-(4-quinolylmethylthio)-N-[4-(trifluoromethoxy)phenyl]benzamide Formula: C24H17F3N2O2S MolecularWeight: 454.46419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)CSC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)CSC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C24H17F3N2O2S/c25-24(26,27)31-18-11-9-17(10-12-18)29-23(30)20-6-2-4-8-22(20)32-15-16-13-14-28-21-7-3-1-5-19(16)21/h1-14H,15H2,(H,29,30)