1-(4,6-dimethylpyrimidin-2-yl)-3,6-dimethyl-5-(phenylmethyl)-2H-pyrazolo[3,4-b]pyridin-4-one

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-3,6-dimethyl-5-(phenylmethyl)-2H-pyrazolo[3,4-b]pyridin-4-one Openeye Name: 5-benzyl-1-(4,6-dimethylpyrimidin-2-yl)-3,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-4-one CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-3,6-dimethyl-5-(phenylmethyl)-2H-pyrazolo[3,4-b]pyridin-4-one IUPAC Name: 5-benzyl-1-(4,6-dimethylpyrimidin-2-yl)-3,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-4-one Traditional Name: 5-benzyl-1-(4,6-dimethylpyrimidin-2-yl)-3,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-4-one Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C3=NC(=C(C(=O)C3=C(N2)C)CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C3=NC(=C(C(=O)C3=C(N2)C)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C21H21N5O/c1-12-10-13(2)23-21(22-12)26-20-18(15(4)25-26)19(27)17(14(3)24-20)11-16-8-6-5-7-9-16/h5-10,25H,11H2,1-4H3