M06

3-chloro-5-{[4-methyl-2-oxo-1-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-1,2-dihydropyridin-3-yl]oxy}benzonitrile


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Chemical Component Summary

Name3-chloro-5-{[4-methyl-2-oxo-1-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-1,2-dihydropyridin-3-yl]oxy}benzonitrile
Identifiers3-chloranyl-5-[4-methyl-2-oxidanylidene-1-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)pyridin-3-yl]oxy-benzenecarbonitrile
FormulaC20 H14 Cl N5 O2
Molecular Weight391.81
TypeNON-POLYMER
Isomeric SMILESCC1=C(C(=O)N(C=C1)Cc2c3cccnc3n[nH]2)Oc4cc(cc(c4)Cl)C#N
InChIInChI=1S/C20H14ClN5O2/c1-12-4-6-26(11-17-16-3-2-5-23-19(16)25-24-17)20(27)18(12)28-15-8-13(10-22)7-14(21)9-15/h2-9H,11H2,1H3,(H,23,24,25)
InChIKeyYMRUCOCNLHJFRC-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count42
Chiral Atom Count0
Bond Count45
Aromatic Bond Count16

Related Resource References

Resource NameReference
PubChem 42644635
ChEMBL CHEMBL1928643