Home > Products > Agrochemicals > Agrochemical Intermediates > 1,3,5-Triazine-2,4(1H,3H)-dione, 6-[(6-chloro-2-methyl-2H-indazol-5-yl)imino]dihydro-3-[(1-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-[(2,4,5-trifluorophenyl)methyl]-, (6E)-
1,3,5-Triazine-2,4(1H,3H)-dione, 6-[(6-chloro-2-methyl-2H-indazol-5-yl)imino]dihydro-3-[(1-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-[(2,4,5-trifluorophenyl)methyl]-, (6E)- structure, CAS 2647530-73-0

1,3,5-Triazine-2,4(1H,3H)-dione, 6-[(6-chloro-2-methyl-2H-indazol-5-yl)imino]dihydro-3-[(1-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-[(2,4,5-trifluorophenyl)methyl]-, (6E)-

CAS Number2647530-73-0

Synonyms

Molecular FormulaC22H17ClF3N9O2

Molecular Weight531.88

Purity

Density

Boiling Point

Melting Point

Flash Point

Appearancesolid

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-1190170 Purity:
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Quality Control of [ 2647530-73-0 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number2647530-73-0
Catalog No.2A-1190170
Chinese NameEnsitrelvir
Molecular FormulaC22H17ClF3N9O2
Molecular Weight531.88
Appearancesolid
Storage Condition2-8°C, sealed, dry
ApplicationEnsitrelvir (S-217622) is the first orally active non-covalent, non-peptide SARS-CoV-2 3CL protease inhibitor (IC50=13nm) [1][2].
PubChem ID459631094
SMILESCn1cnc(Cn2c(=O)nc(Nc3cc4cn(C)nc4cc3Cl)n(Cc3cc(F)c(F)cc3F)c2=O)n1
InChIInChI=1S/C22H17ClF3N9O2/c1-32-7-12-4-18(13(23)5-17(12)30-32)28-20-29-21(36)35(9-19-27-10-33(2)31-19)22(37)34(20)8-11-3-15(25)16(26)6-14(11)24/h3-7,10H,8-9H2,1-2H3,(H,28,29,36)
InChI KeyQMPBBNUOBOFBFS-UHFFFAOYSA-N
NACRES CodeNA.77
UNSPSC51111800
Transport InfoProduct Name: Ensitrelvir
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