2-[[5-[(E)-3-cyclopropyl-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl]methylsulfanyl]-4-phenyl-6-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[[5-[(E)-3-cyclopropyl-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl]methylsulfanyl]-4-phenyl-6-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[[5-[(E)-3-cyclopropyl-3-oxo-prop-1-enyl]-2-methoxy-phenyl]methylsulfanyl]-4-phenyl-6-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[[5-[(E)-3-cyclopropyl-3-oxoprop-1-enyl]-2-methoxyphenyl]methylthio]-4-phenyl-6-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[[5-[(E)-3-cyclopropyl-3-oxoprop-1-enyl]-2-methoxyphenyl]methylsulfanyl]-4-phenyl-6-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[5-[(E)-3-cyclopropyl-3-keto-prop-1-enyl]-2-methoxy-benzyl]thio]-4-phenyl-6-(trifluoromethyl)nicotinonitrile Formula: C27H21F3N2O2S MolecularWeight: 494.52805

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2CC2)CSC3=C(C(=CC(=N3)C(F)(F)F)C4=CC=CC=C4)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2CC2)CSC3=C(C(=CC(=N3)C(F)(F)F)C4=CC=CC=C4)C#N

InChI

InChI=1S/C27H21F3N2O2S/c1-34-24-12-8-17(7-11-23(33)19-9-10-19)13-20(24)16-35-26-22(15-31)21(18-5-3-2-4-6-18)14-25(32-26)27(28,29)30/h2-8,11-14,19H,9-10,16H2,1H3/b11-7+