2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]pyridine-3-carbonitrile CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-3-pyridinecarbonitrile IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]nicotinonitrile Formula: C13H8ClFN2S MolecularWeight: 278.732423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=C(C=CC=N2)C#N)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=C(C=CC=N2)C#N)F

InChI

InChI=1S/C13H8ClFN2S/c14-11-4-1-5-12(15)10(11)8-18-13-9(7-16)3-2-6-17-13/h1-6H,8H2