587006-69-7
5-(4-FLUOROPHENYL)-4-((3-PHENOXYBENZYLIDENE)AMINO)-4H-1,2,4-TRIAZOLE-3-THIOL
Name
5-(4-FLUOROPHENYL)-4-((3-PHENOXYBENZYLIDENE)AMINO)-4H-1,2,4-TRIAZOLE-3-THIOL
Formula
C21 H15 F N4 O S
MolWeight
390.44
1Identification
【Name】
5-(4-FLUOROPHENYL)-4-((3-PHENOXYBENZYLIDENE)AMINO)-4H-1,2,4-TRIAZOLE-3-THIOL
【CAS】
【MDL】
MFCD04032335
【English Synonyms】
【Formula】
C21 H15 F N4 O S
【MolWeight】
390.44
【Inchi】
InChI=1S/C21H15FN4OS/c22-17-11-9-16(10-12-17)20-24-25-21(28)26(20)23-14-15-5-4-8-19(13-15)27-18-6-2-1-3-7-18/h1-14H,(H,25,28)/b23-14+
【InChIKey】
InChIKey=KELDZOSRPYVEKW-OEAKJJBVSA-N
【SMILES】
c1ccc(cc1)Oc2cccc(c2)/C=N/n3c(nnc3S)c4ccc(cc4)F
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(4-FLUOROPHENYL)-4-((3-PHENOXYBENZYLIDENE)AMINO)-4H-1,2,4-TRIAZOLE-3-THIOL.cml
Quick Release
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Sigma-Aldrich Corporation
Catalog No:L406279-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
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Catalog No:L406279-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 587006-69-7 Suppliers>>