Products 2499490-52-5

CAS 2499490-52-5 is the registry number for BuChE-IN-4. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

2-[(4-bromophenyl)methyl-[[7-(2-fluorophenyl)-2,2-dioxo-3,4-dihydrooxathiino[6,5-c]pyrazol-5-yl]methyl]amino]ethanol (CAS 2499490-52-5) is a chemical compound with the molecular formula C21H21BrFN3O4S and a molecular weight of 510.4 g/mol. IUPAC name: 2-[(4-bromophenyl)methyl-[[7-(2-fluorophenyl)-2,2-dioxo-3,4-dihydrooxathiino[6,5-c]pyrazol-5-yl]methyl]amino]ethanol. InChIKey: LDIVPSYYUOVSCS-UHFFFAOYSA-N.

Identity
Molecular formulaC21H21BrFN3O4S
Molecular weight510.4 g/mol
IUPAC name2-[(4-bromophenyl)methyl-[[7-(2-fluorophenyl)-2,2-dioxo-3,4-dihydrooxathiino[6,5-c]pyrazol-5-yl]methyl]amino]ethanol
InChIKeyLDIVPSYYUOVSCS-UHFFFAOYSA-N
SMILESC1CS(=O)(=O)OC2=C1C(=NN2C3=CC=CC=C3F)CN(CCO)CC4=CC=C(C=C4)Br

Computed by PubChem (NCBI)

Synonyms: BuChE-IN-4, orb1686524