(E)-2-(4-methylphenyl)sulfonyl-3-[4-(trifluoromethylsulfanyl)phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(4-methylphenyl)sulfonyl-3-[4-(trifluoromethylsulfanyl)phenyl]prop-2-enenitrile Openeye Name: (E)-2-(p-tolylsulfonyl)-3-[4-(trifluoromethylsulfanyl)phenyl]prop-2-enenitrile CAS Name: (E)-2-(4-methylphenyl)sulfonyl-3-[4-(trifluoromethylthio)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(4-methylphenyl)sulfonyl-3-[4-(trifluoromethylsulfanyl)phenyl]prop-2-enenitrile Traditional Name: (E)-2-tosyl-3-[4-(trifluoromethylthio)phenyl]acrylonitrile Formula: C17H12F3NO2S2 MolecularWeight: 383.40789

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC=C(C=C2)SC(F)(F)F)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CC=C(C=C2)SC(F)(F)F)/C#N

InChI

InChI=1S/C17H12F3NO2S2/c1-12-2-8-15(9-3-12)25(22,23)16(11-21)10-13-4-6-14(7-5-13)24-17(18,19)20/h2-10H,1H3/b16-10+