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

Systemtic Name: 5-(2-butoxy-5-iodanyl-pyridin-3-yl)-3-ethyl-2-(2-morpholin-4-ylethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(2-butoxy-5-iodo-3-pyridyl)-3-ethyl-2-(2-morpholinoethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(2-butoxy-5-iodo-3-pyridinyl)-3-ethyl-2-[2-(4-morpholinyl)ethyl]-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(2-butoxy-5-iodopyridin-3-yl)-3-ethyl-2-(2-morpholin-4-ylethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(2-butoxy-5-iodo-3-pyridyl)-3-ethyl-2-(2-morpholinoethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C22H29IN6O3 MolecularWeight: 552.40853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC=C(C=C1C2=NC(=O)C3=NN(C(=C3N2)CC)CCN4CCOCC4)I

Isomeric SMILES

CCCCOC1=NC=C(C=C1C2=NC(=O)C3=NN(C(=C3N2)CC)CCN4CCOCC4)I

InChI

InChI=1S/C22H29IN6O3/c1-3-5-10-32-22-16(13-15(23)14-24-22)20-25-18-17(4-2)29(27-19(18)21(30)26-20)7-6-28-8-11-31-12-9-28/h13-14H,3-12H2,1-2H3,(H,25,26,30)