539811-32-0
2-[(4-(3-METHYLPHENYL)-5-[[(4-METHYLPHENYL)SULFANYL]METHYL]-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]-N-[2-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
Name
2-[(4-(3-METHYLPHENYL)-5-[[(4-METHYLPHENYL)SULFANYL]METHYL]-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]-N-[2-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
Formula
C26 H23 F3 N4 O S2
MolWeight
528.621
1Identification
【Name】
2-[(4-(3-METHYLPHENYL)-5-[[(4-METHYLPHENYL)SULFANYL]METHYL]-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]-N-[2-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
【CAS】
【MDL】
MFCD05154912
【English Synonyms】
【Formula】
C26 H23 F3 N4 O S2
【MolWeight】
528.621
【Inchi】
InChI=1S/C26H23F3N4OS2/c1-17-10-12-20(13-11-17)35-15-23-31-32-25(33(23)19-7-5-6-18(2)14-19)36-16-24(34)30-22-9-4-3-8-21(22)26(27,28)29/h3-14H,15-16H2,1-2H3,(H,30,34)
【InChIKey】
InChIKey=IEOCLOPMJRHAOB-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)SCc2nnc(n2c3cccc(c3)C)SCC(=O)Nc4ccccc4C(F)(F)F
【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-(3-METHYLPHENYL)-5-[[(4-METHYLPHENYL)SULFANYL]METHYL]-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]-N-[2-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE.cml
Quick Release
5-METHYL-1-(2-OXO-2-[(PROPYLCARBAMOYL)AMINO]ETHYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
1-[2-(4-BROMOPHENOXY)ETHYL]-5-METHYL-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
5-METHYL-1-([(PENTAN-2-YL)CARBAMOYL]METHYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
5-METHYL-1-(2-[(4-METHYLPHENYL)SULFANYL]ETHYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
1-[(DIPROPYLCARBAMOYL)METHYL]-5-METHYL-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
5-METHYL-1-([(2-METHYLBUTAN-2-YL)CARBAMOYL]METHYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
TOP Suppliers
Sigma-Aldrich Corporation
Catalog No:L444944-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 539811-32-0 Suppliers>>
Catalog No:L444944-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 539811-32-0 Suppliers>>
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