5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-[(2-chloro-6-fluorophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-[(2-chloro-6-fluoro-benzyl)thio]-1H-1,2,4-triazole Formula: C9H7ClFN3S MolecularWeight: 243.688383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=NC=NN2)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=NC=NN2)F

InChI

InChI=1S/C9H7ClFN3S/c10-7-2-1-3-8(11)6(7)4-15-9-12-5-13-14-9/h1-3,5H,4H2,(H,12,13,14)