5-methyl-4-[[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]-2-phenyl-pyrazol-3-olate

Systemtic Name: 5-methyl-4-[[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]-2-phenyl-pyrazol-3-olate Openeye Name: 5-methyl-2-phenyl-4-[[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]pyrazol-3-olate CAS Name: 5-methyl-4-[[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]-2-phenyl-3-pyrazololate IUPAC Name: 5-methyl-4-[[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]-2-phenylpyrazol-3-olate Traditional Name: 5-methyl-2-phenyl-4-[[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]pyrazol-3-olate Formula: C20H17N6OS- MolecularWeight: 389.45358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=C(N(N=C3C)C4=CC=CC=C4)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=C(N(N=C3C)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C20H18N6OS/c1-13-8-10-15(11-9-13)18-22-23-20(28)26(18)21-12-17-14(2)24-25(19(17)27)16-6-4-3-5-7-16/h3-12,27H,1-2H3,(H,23,28)/p-1