5-(2-bromophenyl)-3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(2-bromophenyl)-3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-bromophenyl)-3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-bromophenyl)-3-[(2-chloro-6-fluorophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-bromophenyl)-3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-bromophenyl)-3-[(2-chloro-6-fluoro-benzyl)thio]-1H-1,2,4-triazole Formula: C15H10BrClFN3S MolecularWeight: 398.680403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=NN2)SCC3=C(C=CC=C3Cl)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=NN2)SCC3=C(C=CC=C3Cl)F)Br

InChI

InChI=1S/C15H10BrClFN3S/c16-11-5-2-1-4-9(11)14-19-15(21-20-14)22-8-10-12(17)6-3-7-13(10)18/h1-7H,8H2,(H,19,20,21)