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

Systemtic Name: 2-ethoxy-4-[(Z)-[3-(3-phenyl-1H-pyrazol-5-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate Openeye Name: 2-ethoxy-4-[(Z)-[3-(3-phenyl-1H-pyrazol-5-yl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate CAS Name: 2-ethoxy-4-[(Z)-[3-(3-phenyl-1H-pyrazol-5-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate IUPAC Name: 2-ethoxy-4-[(Z)-[3-(3-phenyl-1H-pyrazol-5-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate Traditional Name: 2-ethoxy-4-[(Z)-[3-(3-phenyl-1H-pyrazol-5-yl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate Formula: C20H17N6O2S- MolecularWeight: 405.45298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NN2C(=NNC2=S)C3=CC(=NN3)C4=CC=CC=C4)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N\N2C(=NNC2=S)C3=CC(=NN3)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C20H18N6O2S/c1-2-28-18-10-13(8-9-17(18)27)12-21-26-19(24-25-20(26)29)16-11-15(22-23-16)14-6-4-3-5-7-14/h3-12,27H,2H2,1H3,(H,22,23)(H,25,29)/p-1/b21-12-