1-cyclopentyl-3-ethyl-6-(2-propoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-cyclopentyl-3-ethyl-6-(2-propoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-cyclopentyl-3-ethyl-6-(2-propoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-cyclopentyl-3-ethyl-6-(2-propoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-cyclopentyl-3-ethyl-6-(2-propoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-cyclopentyl-3-ethyl-6-(2-propoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC(=O)C3=C(NN(C3=N2)C4CCCC4)CC

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC(=O)C3=C(NN(C3=N2)C4CCCC4)CC

InChI

InChI=1S/C21H26N4O2/c1-3-13-27-17-12-8-7-11-15(17)19-22-20-18(21(26)23-19)16(4-2)24-25(20)14-9-5-6-10-14/h7-8,11-12,14,24H,3-6,9-10,13H2,1-2H3