539808-98-5
2-[[4-(2,4-DIMETHYLPHENYL)-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-METHYLPHENYL)ACETAMIDE
Name
2-[[4-(2,4-DIMETHYLPHENYL)-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-METHYLPHENYL)ACETAMIDE
Formula
C26 H26 N4 O2 S
MolWeight
458.583
1Identification
【Name】
2-[[4-(2,4-DIMETHYLPHENYL)-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-METHYLPHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD03460715
【English Synonyms】
【Formula】
C26 H26 N4 O2 S
【MolWeight】
458.583
【Inchi】
InChI=1S/C26H26N4O2S/c1-18-9-12-21(13-10-18)27-25(31)17-33-26-29-28-24(16-32-22-7-5-4-6-8-22)30(26)23-14-11-19(2)15-20(23)3/h4-15H,16-17H2,1-3H3,(H,27,31)
【InChIKey】
InChIKey=DIUCYXVTOYEUMJ-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)NC(=O)CSc2nnc(n2c3ccc(cc3C)C)COc4ccccc4
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[[4-(2,4-DIMETHYLPHENYL)-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-METHYLPHENYL)ACETAMIDE.cml
Quick Release
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Sigma-Aldrich Corporation
Catalog No:L444294-1EA 10MG
Country/Region:United States
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Catalog No:L444294-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 539808-98-5 Suppliers>>