578000-53-0
2-[[4-(4-BROMOPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-1-(3,4-DICHLOROPHENYL)ETHANONE
Name
2-[[4-(4-BROMOPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-1-(3,4-DICHLOROPHENYL)ETHANONE
Formula
C21 H13 Br Cl2 N4 O S
MolWeight
520.237
1Identification
【Name】
2-[[4-(4-BROMOPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-1-(3,4-DICHLOROPHENYL)ETHANONE
【CAS】
【MDL】
MFCD03474680
【English Synonyms】
2-[[4-(4-BROMOPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-1-(3,4-DICHLOROPHENYL)ETHANONE
【Formula】
C21 H13 Br Cl2 N4 O S
【MolWeight】
520.237
【Inchi】
InChI=1S/C21H13BrCl2N4OS/c22-15-4-6-16(7-5-15)28-20(14-2-1-9-25-11-14)26-27-21(28)30-12-19(29)13-3-8-17(23)18(24)10-13/h1-11H,12H2
【InChIKey】
InChIKey=PUJHHKMXRPQGFS-UHFFFAOYSA-N
【SMILES】
c1cc(cnc1)c2nnc(n2c3ccc(cc3)Br)SCC(=O)c4ccc(c(c4)Cl)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[[4-(4-BROMOPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-1-(3,4-DICHLOROPHENYL)ETHANONE.cml
Quick Release
TOP Suppliers
Sigma-Aldrich Corporation
Catalog No:L417440-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 578000-53-0 Suppliers>>
Catalog No:L417440-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 578000-53-0 Suppliers>>