1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(5-iodo-2-methylsulfanylthiophen-3-yl)methylideneamino]-5-methyltriazole-4-carboxamide

Base Information

• Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(5-iodo-2-methylsulfanylthiophen-3-yl)methylideneamino]-5-methyltriazole-4-carboxamide
• CAS No.: 5768-19-4
• Molecular Formula: C6H6 N4 O3
• Molecular Weight: 490.3026
• DSSTox Substance ID: DTXSID30417086
• Mol file: 5768-19-4.mol

Synonyms:5768-19-4;1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(5-iodo-2-methylsulfanylthiophen-3-yl)methylideneamino]-5-methyltriazole-4-carboxamide;AC1NT0KZ;DTXSID30417086;BIM-0032273.P001;1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{[5-iodo-2-(methylthio)-3-thienyl]methylene}-5-methyl-1H-1,2,3-triazole-4-carbohydrazide

Chemical Property of 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(5-iodo-2-methylsulfanylthiophen-3-yl)methylideneamino]-5-methyltriazole-4-carboxamide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 2.18g/cm³
• XLogP3: 2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 5
• Exact Mass: 489.94911
• Heavy Atom Count: 25
• Complexity: 518

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=C(SC(=C3)I)SC
• Isomeric SMILES: CC1=C(N=NN1C2=NON=C2N)C(=O)N/N=C/C3=C(SC(=C3)I)SC