587013-88-5
2-[[4-ALLYL-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2-BROMO-4-METHYLPHENYL)ACETAMIDE
Name
2-[[4-ALLYL-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2-BROMO-4-METHYLPHENYL)ACETAMIDE
pro_formula
C18 H17 Br N4 O S2
pro_molWeight
449.395
1Identification
【Name】
2-[[4-ALLYL-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2-BROMO-4-METHYLPHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD04034338
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C18 H17 Br N4 O S2
【pro_molWeight】
449.395
【Inchi】
InChI=1S/C18H17BrN4OS2/c1-3-8-23-17(15-5-4-9-25-15)21-22-18(23)26-11-16(24)20-14-7-6-12(2)10-13(14)19/h3-7,9-10H,1,8,11H2,2H3,(H,20,24)
【InChIKey】
InChIKey=VDDVRYQRTMOOFM-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)Br)NC(=O)CSc2nnc(n2CC=C)c3cccs3
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:5
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-[[4-ALLYL-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2-BROMO-4-METHYLPHENYL)ACETAMIDE.cml
quick_release
SuppliersList
Sigma-Aldrich Corporation
pro_catalogNo:L414131-1EA 10MG
CountryRegion:US
BusinessType:ReagentCompany
http://www.sigma-aldrich.com
More 587013-88-5 select_supply>>
pro_catalogNo:L414131-1EA 10MG
CountryRegion:US
BusinessType:ReagentCompany
http://www.sigma-aldrich.com
More 587013-88-5 select_supply>>