2-butylsulfanyl-6-(4-chlorophenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-butylsulfanyl-6-(4-chlorophenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-butylsulfanyl-6-(4-chlorophenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-(butylthio)-6-(4-chlorophenyl)-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-butylsulfanyl-6-(4-chlorophenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-(butylthio)-6-(4-chlorophenyl)-4-(trifluoromethyl)nicotinonitrile Formula: C17H14ClF3N2S MolecularWeight: 370.81967

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)Cl)C(F)(F)F)C#N

Isomeric SMILES

CCCCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)Cl)C(F)(F)F)C#N

InChI

InChI=1S/C17H14ClF3N2S/c1-2-3-8-24-16-13(10-22)14(17(19,20)21)9-15(23-16)11-4-6-12(18)7-5-11/h4-7,9H,2-3,8H2,1H3