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

Systemtic Name: 1-(3,4-dimethylphenyl)-5-(2-oxidanylidenepropyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-acetonyl-1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(3,4-dimethylphenyl)-5-(2-oxopropyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-(3,4-dimethylphenyl)-5-(2-oxopropyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-acetonyl-1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4O2/c1-10-4-5-13(6-11(10)2)20-15-14(7-18-20)16(22)19(9-17-15)8-12(3)21/h4-7,9H,8H2,1-3H3