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

Systemtic Name: 1-cyclopentyl-3-ethyl-6-(4-imidazol-1-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-cyclopentyl-3-ethyl-6-(4-imidazol-1-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-cyclopentyl-3-ethyl-6-[4-(1-imidazolyl)phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-cyclopentyl-3-ethyl-6-(4-imidazol-1-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-cyclopentyl-3-ethyl-6-(4-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=C(C=C3)N4C=CN=C4)N(N1)C5CCCC5

Isomeric SMILES

CCC1=C2C(=NC(=NC2=O)C3=CC=C(C=C3)N4C=CN=C4)N(N1)C5CCCC5

InChI

InChI=1S/C21H22N6O/c1-2-17-18-20(27(25-17)16-5-3-4-6-16)23-19(24-21(18)28)14-7-9-15(10-8-14)26-12-11-22-13-26/h7-13,16,25H,2-6H2,1H3