573669-21-3
N-[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE
Name
N-[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE
Formula
C21 H19 Cl F3 N3 O2 S2
MolWeight
501.979
1Identification
【Name】
N-[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE
【CAS】
【MDL】
MFCD04017343
【English Synonyms】
【Formula】
C21 H19 Cl F3 N3 O2 S2
【MolWeight】
501.979
【Inchi】
InChI=1S/C21H19ClF3N3O2S2/c1-2-28-19(30)17-12-5-3-4-6-15(12)32-18(17)27-20(28)31-10-16(29)26-11-7-8-14(22)13(9-11)21(23,24)25/h7-9H,2-6,10H2,1H3,(H,26,29)
【InChIKey】
InChIKey=JZEXJIGSSOPIFW-UHFFFAOYSA-N
【SMILES】
CCn1c(=O)c2c3c(sc2nc1SCC(=O)Nc4ccc(c(c4)C(F)(F)F)Cl)CCCC3
【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
N-[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE.cml
Quick Release
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Sigma-Aldrich Corporation
Catalog No:L413135-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
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Catalog No:L413135-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 573669-21-3 Suppliers>>