2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[[4-(2-cyanophenyl)phenyl]methylthio]-6-methyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[4-(2-cyanophenyl)benzyl]thio]-6-methyl-4-(trifluoromethyl)nicotinonitrile Formula: C22H14F3N3S MolecularWeight: 409.42687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C22H14F3N3S/c1-14-10-20(22(23,24)25)19(12-27)21(28-14)29-13-15-6-8-16(9-7-15)18-5-3-2-4-17(18)11-26/h2-10H,13H2,1H3