2-[(5-methanoyl-2-methoxy-phenyl)methylsulfanyl]-4-phenyl-6-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[(5-methanoyl-2-methoxy-phenyl)methylsulfanyl]-4-phenyl-6-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[(5-formyl-2-methoxy-phenyl)methylsulfanyl]-4-phenyl-6-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(5-formyl-2-methoxyphenyl)methylthio]-4-phenyl-6-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(5-formyl-2-methoxyphenyl)methylsulfanyl]-4-phenyl-6-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(5-formyl-2-methoxy-benzyl)thio]-4-phenyl-6-(trifluoromethyl)nicotinonitrile Formula: C22H15F3N2O2S MolecularWeight: 428.42691

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=O)CSC2=C(C(=CC(=N2)C(F)(F)F)C3=CC=CC=C3)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)C=O)CSC2=C(C(=CC(=N2)C(F)(F)F)C3=CC=CC=C3)C#N

InChI

InChI=1S/C22H15F3N2O2S/c1-29-19-8-7-14(12-28)9-16(19)13-30-21-18(11-26)17(15-5-3-2-4-6-15)10-20(27-21)22(23,24)25/h2-10,12H,13H2,1H3