538337-08-5
2-[[4-ALLYL-5-(4-TERT-BUTYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-CHLOROPHENYL)ACETAMIDE
Name
2-[[4-ALLYL-5-(4-TERT-BUTYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-CHLOROPHENYL)ACETAMIDE
Formula
C23 H25 Cl N4 O S
MolWeight
440.996
1Identification
【Name】
2-[[4-ALLYL-5-(4-TERT-BUTYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-CHLOROPHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD05154824
【English Synonyms】
【Formula】
C23 H25 Cl N4 O S
【MolWeight】
440.996
【Inchi】
InChI=1S/C23H25ClN4OS/c1-5-14-28-21(16-6-8-17(9-7-16)23(2,3)4)26-27-22(28)30-15-20(29)25-19-12-10-18(24)11-13-19/h5-13H,1,14-15H2,2-4H3,(H,25,29)
【InChIKey】
InChIKey=DKNDGGJFBXFFLE-UHFFFAOYSA-N
【SMILES】
CC(C)(C)c1ccc(cc1)c2nnc(n2CC=C)SCC(=O)Nc3ccc(cc3)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[[4-ALLYL-5-(4-TERT-BUTYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(4-CHLOROPHENYL)ACETAMIDE.cml
Quick Release
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Sigma-Aldrich Corporation
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Catalog No:L442682-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 538337-08-5 Suppliers>>