2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-N-(2-cyanoethyl)ethanamide

Systemtic Name: 2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-N-(2-cyanoethyl)ethanamide Openeye Name: 2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-N-(2-cyanoethyl)acetamide CAS Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-N-(2-cyanoethyl)acetamide IUPAC Name: 2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-N-(2-cyanoethyl)acetamide Traditional Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-N-(2-cyanoethyl)acetamide Formula: C12H10ClF3N2OS MolecularWeight: 322.73381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SCC(=O)NCCC#N)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1SCC(=O)NCCC#N)C(F)(F)F)Cl

InChI

InChI=1S/C12H10ClF3N2OS/c13-10-3-2-8(6-9(10)12(14,15)16)20-7-11(19)18-5-1-4-17/h2-3,6H,1,5,7H2,(H,18,19)