6-phenyl-2-propylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-phenyl-2-propylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-phenyl-2-propylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-phenyl-2-(propylthio)-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-phenyl-2-propylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-phenyl-2-(propylthio)-4-(trifluoromethyl)nicotinonitrile Formula: C16H13F3N2S MolecularWeight: 322.34803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C(F)(F)F)C#N

Isomeric SMILES

CCCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C(F)(F)F)C#N

InChI

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