6-methyl-5-(3-methylbutyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-methyl-5-(3-methylbutyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-isopentyl-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-methyl-5-(3-methylbutyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 6-methyl-5-(3-methylbutyl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-isoamyl-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H20N4O MolecularWeight: 296.3669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CCC(C)C

Isomeric SMILES

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CCC(C)C

InChI

InChI=1S/C17H20N4O/c1-12(2)9-10-20-13(3)19-16-15(17(20)22)11-18-21(16)14-7-5-4-6-8-14/h4-8,11-12H,9-10H2,1-3H3