N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)-2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanamide

Systemtic Name: N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)-2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanamide Openeye Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-(2H-triazol-4-ylsulfanyl)acetamide CAS Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-(2H-triazol-4-ylthio)acetamide IUPAC Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-(2H-triazol-4-ylsulfanyl)acetamide Traditional Name: N-(5-keto-1-phenyl-2-pyrazolin-3-yl)-2-(2H-triazol-4-ylthio)acetamide Formula: C13H12N6O2S MolecularWeight: 316.33838

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=CC=C2)NC(=O)CSC3=NNN=C3

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=CC=C2)NC(=O)CSC3=NNN=C3

InChI

InChI=1S/C13H12N6O2S/c20-11(8-22-12-7-14-18-16-12)15-10-6-13(21)19(17-10)9-4-2-1-3-5-9/h1-5,7H,6,8H2,(H,14,16,18)(H,15,17,20)