5-(2-ethoxyphenyl)-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-(2-ethoxyphenyl)-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(2-ethoxyphenyl)-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(2-ethoxyphenyl)-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(2-ethoxyphenyl)-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 1-ethyl-5-o-phenetyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=CC=C3OCC)CC

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=CC=C3OCC)CC

InChI

InChI=1S/C18H22N4O2/c1-4-9-13-15-16(22(5-2)21-13)18(23)20-17(19-15)12-10-7-8-11-14(12)24-6-3/h7-8,10-11H,4-6,9H2,1-3H3,(H,19,20,23)