538336-83-3
2-[[4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-ETHYLPHENYL)ACETAMIDE
Name
2-[[4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-ETHYLPHENYL)ACETAMIDE
Formula
C26 H26 N4 O2 S
MolWeight
458.583
1Identification
【Name】
2-[[4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-ETHYLPHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD04211428
【English Synonyms】
【Formula】
C26 H26 N4 O2 S
【MolWeight】
458.583
【Inchi】
InChI=1S/C26H26N4O2S/c1-2-20-13-15-22(16-14-20)27-25(31)19-33-26-29-28-24(18-32-23-11-7-4-8-12-23)30(26)17-21-9-5-3-6-10-21/h3-16H,2,17-19H2,1H3,(H,27,31)
【InChIKey】
InChIKey=KNXDWMWFMKWIBI-UHFFFAOYSA-N
【SMILES】
CCc1ccc(cc1)NC(=O)CSc2nnc(n2Cc3ccccc3)COc4ccccc4
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[[4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-ETHYLPHENYL)ACETAMIDE.cml
Quick Release
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Sigma-Aldrich Corporation
Catalog No:L442429-1EA 10MG
Country/Region:United States
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Catalog No:L442429-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 538336-83-3 Suppliers>>