1-(3,5-dimethylphenyl)-5-(2-pyridin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(3,5-dimethylphenyl)-5-(2-pyridin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(3,5-dimethylphenyl)-5-[2-(4-pyridyl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(3,5-dimethylphenyl)-5-(2-pyridin-4-ylethyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-(3,5-dimethylphenyl)-5-(2-pyridin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(3,5-dimethylphenyl)-5-[2-(4-pyridyl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H19N5O MolecularWeight: 345.39776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C3=C(C=N2)C(=O)N(C=N3)CCC4=CC=NC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C3=C(C=N2)C(=O)N(C=N3)CCC4=CC=NC=C4)C

InChI

InChI=1S/C20H19N5O/c1-14-9-15(2)11-17(10-14)25-19-18(12-23-25)20(26)24(13-22-19)8-5-16-3-6-21-7-4-16/h3-4,6-7,9-13H,5,8H2,1-2H3