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

Systemtic Name: 6-methyl-2-[(2-methylphenyl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-methyl-2-(o-tolylmethylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-methyl-2-[(2-methylphenyl)methylthio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-methyl-2-[(2-methylphenyl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-methyl-2-[(2-methylbenzyl)thio]-4-(trifluoromethyl)nicotinonitrile Formula: C16H13F3N2S MolecularWeight: 322.34803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C(=CC(=N2)C)C(F)(F)F)C#N

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C(=CC(=N2)C)C(F)(F)F)C#N

InChI

InChI=1S/C16H13F3N2S/c1-10-5-3-4-6-12(10)9-22-15-13(8-20)14(16(17,18)19)7-11(2)21-15/h3-7H,9H2,1-2H3