4-[bis(fluoranyl)methylsulfanyl]-N-(pyridin-4-ylmethyl)aniline

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-N-(pyridin-4-ylmethyl)aniline Openeye Name: 4-(difluoromethylsulfanyl)-N-(4-pyridylmethyl)aniline CAS Name: 4-(difluoromethylthio)-N-(pyridin-4-ylmethyl)aniline IUPAC Name: 4-(difluoromethylsulfanyl)-N-(pyridin-4-ylmethyl)aniline Traditional Name: [4-(difluoromethylthio)phenyl]-(4-pyridylmethyl)amine Formula: C13H12F2N2S MolecularWeight: 266.309586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=CC=NC=C2)SC(F)F

Isomeric SMILES

C1=CC(=CC=C1NCC2=CC=NC=C2)SC(F)F

InChI

InChI=1S/C13H12F2N2S/c14-13(15)18-12-3-1-11(2-4-12)17-9-10-5-7-16-8-6-10/h1-8,13,17H,9H2