N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[[4-methyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[[4-methyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[[4-methyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-2-[[4-methyl-5-[(phenylthio)methyl]-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-2-[[4-methyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[[4-methyl-5-[(phenylthio)methyl]-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H19N7OS2 MolecularWeight: 461.56256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N)CSC4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N)CSC4=CC=CC=C4

InChI

InChI=1S/C22H19N7OS2/c1-28-19(14-31-18-10-6-3-7-11-18)26-27-22(28)32-15-20(30)25-21-16(12-23)13-24-29(21)17-8-4-2-5-9-17/h2-11,13H,14-15H2,1H3,(H,25,30)