N-[2-(2-cyanoethylsulfanyl)phenyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-(2-cyanoethylthio)phenyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-(2-cyanoethylthio)phenyl]-3-(trifluoromethyl)benzamide Formula: C17H13F3N2OS MolecularWeight: 350.35813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)SCCC#N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)SCCC#N

InChI

InChI=1S/C17H13F3N2OS/c18-17(19,20)13-6-3-5-12(11-13)16(23)22-14-7-1-2-8-15(14)24-10-4-9-21/h1-3,5-8,11H,4,10H2,(H,22,23)