3-[3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]pyridine

Systemtic Name: 3-[3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]pyridine Openeye Name: 3-[3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]pyridine CAS Name: 3-[3-[(2-chloro-6-fluorophenyl)methylthio]-1H-1,2,4-triazol-5-yl]pyridine IUPAC Name: 3-[3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]pyridine Traditional Name: 3-[3-[(2-chloro-6-fluoro-benzyl)thio]-1H-1,2,4-triazol-5-yl]pyridine Formula: C14H10ClFN4S MolecularWeight: 320.772403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=NNC(=N2)C3=CN=CC=C3)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=NNC(=N2)C3=CN=CC=C3)F

InChI

InChI=1S/C14H10ClFN4S/c15-11-4-1-5-12(16)10(11)8-21-14-18-13(19-20-14)9-3-2-6-17-7-9/h1-7H,8H2,(H,18,19,20)