3-[[4-(trifluoromethylsulfanyl)phenyl]methylamino]benzenecarbonitrile

Systemtic Name: 3-[[4-(trifluoromethylsulfanyl)phenyl]methylamino]benzenecarbonitrile Openeye Name: 3-[[4-(trifluoromethylsulfanyl)phenyl]methylamino]benzonitrile CAS Name: 3-[[4-(trifluoromethylthio)phenyl]methylamino]benzonitrile IUPAC Name: 3-[[4-(trifluoromethylsulfanyl)phenyl]methylamino]benzonitrile Traditional Name: 3-[[4-(trifluoromethylthio)benzyl]amino]benzonitrile Formula: C15H11F3N2S MolecularWeight: 308.32145

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC2=CC=C(C=C2)SC(F)(F)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NCC2=CC=C(C=C2)SC(F)(F)F)C#N

InChI

InChI=1S/C15H11F3N2S/c16-15(17,18)21-14-6-4-11(5-7-14)10-20-13-3-1-2-12(8-13)9-19/h1-8,20H,10H2