5-(3,3-dimethyl-2-oxidanylidene-butyl)-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(3,3-dimethyl-2-oxidanylidene-butyl)-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-(3,3-dimethyl-2-oxo-butyl)-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(3,3-dimethyl-2-oxobutyl)-1-(2,4-dimethylphenyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-(3,3-dimethyl-2-oxobutyl)-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(2,4-dimethylphenyl)-5-(2-keto-3,3-dimethyl-butyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H22N4O2 MolecularWeight: 338.40358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O2/c1-12-6-7-15(13(2)8-12)23-17-14(9-21-23)18(25)22(11-20-17)10-16(24)19(3,4)5/h6-9,11H,10H2,1-5H3