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

Systemtic Name: 5-methyl-2-phenyl-4-[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]pyrazol-3-olate Openeye Name: 5-methyl-2-phenyl-4-[(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]pyrazol-3-olate CAS Name: 5-methyl-2-phenyl-4-[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-3-pyrazololate IUPAC Name: 5-methyl-2-phenyl-4-[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]pyrazol-3-olate Traditional Name: 5-methyl-2-phenyl-4-[(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]pyrazol-3-olate Formula: C19H15N6OS- MolecularWeight: 375.427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NN2C(=NNC2=S)C3=CC=CC=C3)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C=NN2C(=NNC2=S)C3=CC=CC=C3)[O-])C4=CC=CC=C4

InChI

InChI=1S/C19H16N6OS/c1-13-16(18(26)24(23-13)15-10-6-3-7-11-15)12-20-25-17(21-22-19(25)27)14-8-4-2-5-9-14/h2-12,26H,1H3,(H,22,27)/p-1