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

Systemtic Name: 4-[(Z)-[3-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate Openeye Name: 4-[(Z)-[3-(4-bromophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate CAS Name: 4-[(Z)-[3-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate IUPAC Name: 4-[(Z)-[3-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate Traditional Name: 4-[(Z)-[3-(4-bromophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate Formula: C15H10BrN4OS- MolecularWeight: 374.2351

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NN2C(=NNC2=S)C3=CC=C(C=C3)Br)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=N\N2C(=NNC2=S)C3=CC=C(C=C3)Br)[O-]

InChI

InChI=1S/C15H11BrN4OS/c16-12-5-3-11(4-6-12)14-18-19-15(22)20(14)17-9-10-1-7-13(21)8-2-10/h1-9,21H,(H,19,22)/p-1/b17-9-