(Z)-3-[[3,5-bis(trifluoromethyl)phenyl]amino]-2-pyridin-2-ylsulfonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-[[3,5-bis(trifluoromethyl)phenyl]amino]-2-pyridin-2-ylsulfonyl-prop-2-enenitrile Openeye Name: (Z)-3-[3,5-bis(trifluoromethyl)anilino]-2-(2-pyridylsulfonyl)prop-2-enenitrile CAS Name: (Z)-3-[3,5-bis(trifluoromethyl)anilino]-2-(2-pyridinylsulfonyl)-2-propenenitrile IUPAC Name: (Z)-3-[3,5-bis(trifluoromethyl)anilino]-2-pyridin-2-ylsulfonylprop-2-enenitrile Traditional Name: (Z)-3-[3,5-bis(trifluoromethyl)anilino]-2-(2-pyridylsulfonyl)acrylonitrile Formula: C16H9F6N3O2S MolecularWeight: 421.316979

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)S(=O)(=O)C(=CNC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

C1=CC=NC(=C1)S(=O)(=O)/C(=C\NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)/C#N

InChI

InChI=1S/C16H9F6N3O2S/c17-15(18,19)10-5-11(16(20,21)22)7-12(6-10)25-9-13(8-23)28(26,27)14-3-1-2-4-24-14/h1-7,9,25H/b13-9-