4-(4-bromophenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-bromophenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-bromophenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-bromophenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-bromophenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-bromophenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C15H11BrN3OS- MolecularWeight: 361.23634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Br)[S-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Br)[S-]

InChI

InChI=1S/C15H12BrN3OS/c1-20-13-8-2-10(3-9-13)14-17-18-15(21)19(14)12-6-4-11(16)5-7-12/h2-9H,1H3,(H,18,21)/p-1