(Z)-2-cyano-3-sulfanyl-N-[4-(trifluoromethyl)phenyl]but-2-enamide

Systemtic Name: (Z)-2-cyano-3-sulfanyl-N-[4-(trifluoromethyl)phenyl]but-2-enamide Openeye Name: (Z)-2-cyano-3-sulfanyl-N-[4-(trifluoromethyl)phenyl]but-2-enamide CAS Name: (Z)-2-cyano-3-mercapto-N-[4-(trifluoromethyl)phenyl]-2-butenamide IUPAC Name: (Z)-2-cyano-3-sulfanyl-N-[4-(trifluoromethyl)phenyl]but-2-enamide Traditional Name: (Z)-2-cyano-3-mercapto-N-[4-(trifluoromethyl)phenyl]but-2-enamide Formula: C12H9F3N2OS MolecularWeight: 286.27287

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F)S

Isomeric SMILES

C/C(=C(\C#N)/C(=O)NC1=CC=C(C=C1)C(F)(F)F)/S

InChI

InChI=1S/C12H9F3N2OS/c1-7(19)10(6-16)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,19H,1H3,(H,17,18)/b10-7-