2-azanyl-4-piperidin-1-yl-6-[[6-(trifluoromethyl)pyridin-3-yl]methylsulfanyl]pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-piperidin-1-yl-6-[[6-(trifluoromethyl)pyridin-3-yl]methylsulfanyl]pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(1-piperidyl)-6-[[6-(trifluoromethyl)-3-pyridyl]methylsulfanyl]pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(1-piperidinyl)-6-[[6-(trifluoromethyl)-3-pyridinyl]methylthio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-piperidin-1-yl-6-[[6-(trifluoromethyl)pyridin-3-yl]methylsulfanyl]pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-piperidino-6-[[6-(trifluoromethyl)-3-pyridyl]methylthio]dinicotinonitrile Formula: C19H17F3N6S MolecularWeight: 418.43869

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NC(=C2C#N)SCC3=CN=C(C=C3)C(F)(F)F)N)C#N

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NC(=C2C#N)SCC3=CN=C(C=C3)C(F)(F)F)N)C#N

InChI

InChI=1S/C19H17F3N6S/c20-19(21,22)15-5-4-12(10-26-15)11-29-18-14(9-24)16(13(8-23)17(25)27-18)28-6-2-1-3-7-28/h4-5,10H,1-3,6-7,11H2,(H2,25,27)