Chemical Component Summary

NameN-(3-methyl-5-{[(2S)-4-oxoazetidin-2-yl]oxy}phenyl)-2-(pyrimidin-5-yl)acetamide
Identifiers~{N}-[3-methyl-5-[(2~{S})-4-oxidanylideneazetidin-2-yl]oxy-phenyl]-2-pyrimidin-5-yl-ethanamide
FormulaC16 H16 N4 O3
Molecular Weight312.323
TypeNON-POLYMER
Isomeric SMILESCc1cc(cc(c1)O[C@H]2CC(=O)N2)NC(=O)Cc3cncnc3
InChIInChI=1S/C16H16N4O3/c1-10-2-12(5-13(3-10)23-16-6-15(22)20-16)19-14(21)4-11-7-17-9-18-8-11/h2-3,5,7-9,16H,4,6H2,1H3,(H,19,21)(H,20,22)/t16-/m0/s1
InChIKeyBBXRTGNKDKIMPV-INIZCTEOSA-N

Chemical Details

Formal Charge0
Atom Count39
Chiral Atom Count1
Bond Count41
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 169408174