4-(4-bromanyl-2-chloranyl-phenyl)-5-[(4-fluorophenyl)methylsulfanylmethyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-bromanyl-2-chloranyl-phenyl)-5-[(4-fluorophenyl)methylsulfanylmethyl]-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-bromo-2-chloro-phenyl)-5-[(4-fluorophenyl)methylsulfanylmethyl]-1,2,4-triazole-3-thiolate CAS Name: 4-(4-bromo-2-chlorophenyl)-5-[[(4-fluorophenyl)methylthio]methyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-bromo-2-chlorophenyl)-5-[(4-fluorophenyl)methylsulfanylmethyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-bromo-2-chloro-phenyl)-5-[[(4-fluorobenzyl)thio]methyl]-1,2,4-triazole-3-thiolate Formula: C16H11BrClFN3S2- MolecularWeight: 443.764043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCC2=NN=C(N2C3=C(C=C(C=C3)Br)Cl)[S-])F

Isomeric SMILES

C1=CC(=CC=C1CSCC2=NN=C(N2C3=C(C=C(C=C3)Br)Cl)[S-])F

InChI

InChI=1S/C16H12BrClFN3S2/c17-11-3-6-14(13(18)7-11)22-15(20-21-16(22)23)9-24-8-10-1-4-12(19)5-2-10/h1-7H,8-9H2,(H,21,23)/p-1