2-(azetidin-3-yl)-5-(2-butoxy-5-ethanoyl-pyridin-3-yl)-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 2-(azetidin-3-yl)-5-(2-butoxy-5-ethanoyl-pyridin-3-yl)-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(5-acetyl-2-butoxy-3-pyridyl)-2-(azetidin-3-yl)-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(5-acetyl-2-butoxy-3-pyridinyl)-2-(3-azetidinyl)-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(5-acetyl-2-butoxypyridin-3-yl)-2-(azetidin-3-yl)-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(5-acetyl-2-butoxy-3-pyridyl)-2-(azetidin-3-yl)-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC=C(C=C1C2=NC(=O)C3=NN(C(=C3N2)CC)C4CNC4)C(=O)C

Isomeric SMILES

CCCCOC1=NC=C(C=C1C2=NC(=O)C3=NN(C(=C3N2)CC)C4CNC4)C(=O)C

InChI

InChI=1S/C21H26N6O3/c1-4-6-7-30-21-15(8-13(9-23-21)12(3)28)19-24-17-16(5-2)27(14-10-22-11-14)26-18(17)20(29)25-19/h8-9,14,22H,4-7,10-11H2,1-3H3,(H,24,25,29)