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

Systemtic Name: 1-cyclopentyl-3-ethyl-6-(2-imidazol-1-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-cyclopentyl-3-ethyl-6-(2-imidazol-1-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-cyclopentyl-3-ethyl-6-[2-(1-imidazolyl)phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-cyclopentyl-3-ethyl-6-(2-imidazol-1-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-cyclopentyl-3-ethyl-6-(2-imidazol-1-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H22N6O MolecularWeight: 374.43898

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=NC2=O)C3=CC=CC=C3N4C=CN=C4)N(N1)C5CCCC5

Isomeric SMILES

CCC1=C2C(=NC(=NC2=O)C3=CC=CC=C3N4C=CN=C4)N(N1)C5CCCC5

InChI

InChI=1S/C21H22N6O/c1-2-16-18-20(27(25-16)14-7-3-4-8-14)23-19(24-21(18)28)15-9-5-6-10-17(15)26-12-11-22-13-26/h5-6,9-14,25H,2-4,7-8H2,1H3