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

Systemtic Name: 2-[2-azanyl-4-(trifluoromethyl)phenyl]sulfanyl-N-(2-cyanoethyl)ethanamide Openeye Name: 2-[2-amino-4-(trifluoromethyl)phenyl]sulfanyl-N-(2-cyanoethyl)acetamide CAS Name: 2-[[2-amino-4-(trifluoromethyl)phenyl]thio]-N-(2-cyanoethyl)acetamide IUPAC Name: 2-[2-amino-4-(trifluoromethyl)phenyl]sulfanyl-N-(2-cyanoethyl)acetamide Traditional Name: 2-[[2-amino-4-(trifluoromethyl)phenyl]thio]-N-(2-cyanoethyl)acetamide Formula: C12H12F3N3OS MolecularWeight: 303.30339

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)N)SCC(=O)NCCC#N

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)N)SCC(=O)NCCC#N

InChI

InChI=1S/C12H12F3N3OS/c13-12(14,15)8-2-3-10(9(17)6-8)20-7-11(19)18-5-1-4-16/h2-3,6H,1,5,7,17H2,(H,18,19)