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

Systemtic Name: 4-(4-bromophenyl)-5-(furan-2-yl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-bromophenyl)-5-(2-furyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-bromophenyl)-5-(2-furanyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-bromophenyl)-5-(furan-2-yl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-bromophenyl)-5-(2-furyl)-1,2,4-triazole-3-thiolate Formula: C12H7BrN3OS- MolecularWeight: 321.17248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8BrN3OS/c13-8-3-5-9(6-4-8)16-11(14-15-12(16)18)10-2-1-7-17-10/h1-7H,(H,15,18)/p-1