5-[(4-bromophenyl)methyl]-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(4-bromophenyl)methyl]-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(4-bromophenyl)methyl]-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(4-bromophenyl)methyl]-1-tert-butyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(4-bromophenyl)methyl]-1-tert-butylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(4-bromobenzyl)-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H17BrN4O MolecularWeight: 361.23638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C=N1)C(=O)N(C=N2)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C)N1C2=C(C=N1)C(=O)N(C=N2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H17BrN4O/c1-16(2,3)21-14-13(8-19-21)15(22)20(10-18-14)9-11-4-6-12(17)7-5-11/h4-8,10H,9H2,1-3H3