2-[4-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenolate

Systemtic Name: 2-[4-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenolate Openeye Name: 2-[4-(4-bromophenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]phenolate CAS Name: 2-[4-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenolate IUPAC Name: 2-[4-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenolate Traditional Name: 2-[4-(4-bromophenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]phenolate Formula: C14H9BrN3OS- MolecularWeight: 347.20976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NNC(=S)N2C3=CC=C(C=C3)Br)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NNC(=S)N2C3=CC=C(C=C3)Br)[O-]

InChI

InChI=1S/C14H10BrN3OS/c15-9-5-7-10(8-6-9)18-13(16-17-14(18)20)11-3-1-2-4-12(11)19/h1-8,19H,(H,17,20)/p-1