2-{2-[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-2-phenylhydrazino}-N-phenyl-2-thioxoacetamide

Base Information

• Chemical Name: 2-{2-[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-2-phenylhydrazino}-N-phenyl-2-thioxoacetamide
• CAS No.: 204077-10-1
• Molecular Formula: C29H24N6OS
• Molecular Weight: 504.6
• DSSTox Substance ID: DTXSID701108644
• ChEMBL ID: CHEMBL1605733
• Mol file: 204077-10-1.mol

Synonyms:MLS000703807;2-{2-[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-2-phenylhydrazino}-N-phenyl-2-thioxoacetamide;SMR000226915;2-[2-[5-(4-methylphenyl)-4-phenyl-1,2,4-triazol-3-yl]-2-phenylhydrazinyl]-N-phenyl-2-sulfanylideneacetamide;Oprea1_692368;AJ-981/40633422;CHEMBL1605733;BDBM55659;cid_1825875;RZTJQNMYXHHCSC-UHFFFAOYSA-N;DTXSID701108644;HMS2618H18;2-[2-[5-(4-methylphenyl)-4-phenyl-1,2,4-triazol-3-yl]-2-phenyl-hydrazinyl]-N-phenyl-2-sulfanylidene-ethanamide;2-Oxo-2-(phenylamino)ethanethioic acid 2-[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-2-phenylhydrazide;204077-10-1;N-phenyl-2-[N''-phenyl-N''-[4-phenyl-5-(p-tolyl)-1,2,4-triazol-3-yl]hydrazino]-2-thioxo-acetamide

Chemical Property of 2-{2-[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-2-phenylhydrazino}-N-phenyl-2-thioxoacetamide

Chemical Property:

• XLogP3: 6.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 504.17323058
• Heavy Atom Count: 37
• Complexity: 741

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)N(C4=CC=CC=C4)NC(=S)C(=O)NC5=CC=CC=C5