KA7

N-{3-[(2-aminopyrimidin-5-yl)ethynyl]-2,4-difluorophenyl}-5-chloro-2-methoxypyridine-3-sulfonamide


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Chemical Component Summary

NameN-{3-[(2-aminopyrimidin-5-yl)ethynyl]-2,4-difluorophenyl}-5-chloro-2-methoxypyridine-3-sulfonamide
Identifiers~{N}-[3-[2-(2-azanylpyrimidin-5-yl)ethynyl]-2,4-bis(fluoranyl)phenyl]-5-chloranyl-2-methoxy-pyridine-3-sulfonamide
FormulaC18 H12 Cl F2 N5 O3 S
Molecular Weight451.834
TypeNON-POLYMER
Isomeric SMILESCOc1c(cc(cn1)Cl)S(=O)(=O)Nc2ccc(c(c2F)C#Cc3cnc(nc3)N)F
InChIInChI=1S/C18H12ClF2N5O3S/c1-29-17-15(6-11(19)9-23-17)30(27,28)26-14-5-4-13(20)12(16(14)21)3-2-10-7-24-18(22)25-8-10/h4-9,26H,1H3,(H2,22,24,25)
InChIKeyJGHVXJKGYJYWOP-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count42
Chiral Atom Count0
Bond Count44
Aromatic Bond Count18

Related Resource References

Resource NameReference
PubChem 134814489