5-(2-methylpropyl)-1,6-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(2-methylpropyl)-1,6-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-isobutyl-1,6-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(2-methylpropyl)-1,6-diphenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-(2-methylpropyl)-1,6-diphenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-isobutyl-1,6-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H20N4O MolecularWeight: 344.4097

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NC2=C(C1=O)C=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CN1C(=NC2=C(C1=O)C=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O/c1-15(2)14-24-19(16-9-5-3-6-10-16)23-20-18(21(24)26)13-22-25(20)17-11-7-4-8-12-17/h3-13,15H,14H2,1-2H3