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

Systemtic Name: 5-(2-butoxy-5-ethanoyl-pyridin-3-yl)-3-ethyl-2-(2-methoxyethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(5-acetyl-2-butoxy-3-pyridyl)-3-ethyl-2-(2-methoxyethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(5-acetyl-2-butoxy-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-(2-methoxyethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(5-acetyl-2-butoxy-3-pyridyl)-3-ethyl-2-(2-methoxyethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O4/c1-5-7-9-30-21-15(11-14(12-22-21)13(3)27)19-23-17-16(6-2)26(8-10-29-4)25-18(17)20(28)24-19/h11-12H,5-10H2,1-4H3,(H,23,24,28)