4-thiophen-2-yl-2-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 4-thiophen-2-yl-2-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 4-(2-thienyl)-2-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 4-thiophen-2-yl-2-[[2-(trifluoromethyl)phenyl]methylthio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 4-thiophen-2-yl-2-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 4-(2-thienyl)-2-[[2-(trifluoromethyl)benzyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H17F3N2S2 MolecularWeight: 430.50899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=N2)SCC3=CC=CC=C3C(F)(F)F)C#N)C4=CC=CS4

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=N2)SCC3=CC=CC=C3C(F)(F)F)C#N)C4=CC=CS4

InChI

InChI=1S/C22H17F3N2S2/c23-22(24,25)17-8-3-1-6-14(17)13-29-21-16(12-26)20(19-10-5-11-28-19)15-7-2-4-9-18(15)27-21/h1,3,5-6,8,10-11H,2,4,7,9,13H2