3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole

Systemtic Name: 3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Openeye Name: 3-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-5-(2-thienyl)-1H-1,2,4-triazole CAS Name: 3-[(4-bromo-2-fluorophenyl)methylthio]-5-thiophen-2-yl-1H-1,2,4-triazole IUPAC Name: 3-[(4-bromo-2-fluorophenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Traditional Name: 3-[(4-bromo-2-fluoro-benzyl)thio]-5-(2-thienyl)-1H-1,2,4-triazole Formula: C13H9BrFN3S2 MolecularWeight: 370.263063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NN2)SCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NN2)SCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C13H9BrFN3S2/c14-9-4-3-8(10(15)6-9)7-20-13-16-12(17-18-13)11-2-1-5-19-11/h1-6H,7H2,(H,16,17,18)