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

Systemtic Name: 5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-[(4-bromo-2-fluorophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-[(4-bromo-2-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-[(4-bromo-2-fluoro-benzyl)thio]-1H-1,2,4-triazole Formula: C9H7BrFN3S MolecularWeight: 288.139383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)CSC2=NC=NN2

Isomeric SMILES

C1=CC(=C(C=C1Br)F)CSC2=NC=NN2

InChI

InChI=1S/C9H7BrFN3S/c10-7-2-1-6(8(11)3-7)4-15-9-12-5-13-14-9/h1-3,5H,4H2,(H,12,13,14)