(E)-3-(4-methylsulfanylphenyl)-2-[4-(trifluoromethyloxy)phenyl]sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(4-methylsulfanylphenyl)-2-[4-(trifluoromethyloxy)phenyl]sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-methylsulfanylphenyl)-2-[4-(trifluoromethoxy)phenyl]sulfonyl-prop-2-enenitrile CAS Name: (E)-3-[4-(methylthio)phenyl]-2-[4-(trifluoromethoxy)phenyl]sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(4-methylsulfanylphenyl)-2-[4-(trifluoromethoxy)phenyl]sulfonylprop-2-enenitrile Traditional Name: (E)-3-[4-(methylthio)phenyl]-2-[4-(trifluoromethoxy)phenyl]sulfonyl-acrylonitrile Formula: C17H12F3NO3S2 MolecularWeight: 399.40729

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C17H12F3NO3S2/c1-25-14-6-2-12(3-7-14)10-16(11-21)26(22,23)15-8-4-13(5-9-15)24-17(18,19)20/h2-10H,1H3/b16-10+