(E)-3-fluoranyl-3-(2-oxidanylidenepropylsulfanyl)-2-(trifluoromethyl)prop-2-enenitrile

Systemtic Name: (E)-3-fluoranyl-3-(2-oxidanylidenepropylsulfanyl)-2-(trifluoromethyl)prop-2-enenitrile Openeye Name: (E)-3-acetonylsulfanyl-3-fluoro-2-(trifluoromethyl)prop-2-enenitrile CAS Name: (E)-3-fluoro-3-(2-oxopropylthio)-2-(trifluoromethyl)-2-propenenitrile IUPAC Name: (E)-3-fluoro-3-(2-oxopropylsulfanyl)-2-(trifluoromethyl)prop-2-enenitrile Traditional Name: (E)-3-(acetonylthio)-3-fluoro-2-(trifluoromethyl)acrylonitrile Formula: C7H5F4NOS MolecularWeight: 227.179313

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC(=C(C#N)C(F)(F)F)F

Isomeric SMILES

CC(=O)CS/C(=C(\C#N)/C(F)(F)F)/F

InChI

InChI=1S/C7H5F4NOS/c1-4(13)3-14-6(8)5(2-12)7(9,10)11/h3H2,1H3/b6-5+