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

Systemtic Name: 3-(2-bromophenyl)-5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-bromophenyl)-5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole CAS Name: 3-(2-bromophenyl)-5-[(2-chloro-6-fluorophenyl)methylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-(2-bromophenyl)-5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-(2-bromophenyl)-5-[(2-chloro-6-fluoro-benzyl)thio]-4-phenyl-1,2,4-triazole Formula: C21H14BrClFN3S MolecularWeight: 474.776363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)F)C4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)F)C4=CC=CC=C4Br

InChI

InChI=1S/C21H14BrClFN3S/c22-17-10-5-4-9-15(17)20-25-26-21(27(20)14-7-2-1-3-8-14)28-13-16-18(23)11-6-12-19(16)24/h1-12H,13H2