6-(1-bromanylpropyl)-2,3-dimethyl-5-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-(1-bromanylpropyl)-2,3-dimethyl-5-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-benzyl-6-(1-bromopropyl)-2,3-dimethyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(1-bromopropyl)-2,3-dimethyl-5-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-benzyl-6-(1-bromopropyl)-2,3-dimethylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-benzyl-6-(1-bromopropyl)-2,3-dimethyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H19BrN4O MolecularWeight: 375.26296

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=NN(C(=C2C(=O)N1CC3=CC=CC=C3)C)C)Br

Isomeric SMILES

CCC(C1=NC2=NN(C(=C2C(=O)N1CC3=CC=CC=C3)C)C)Br

InChI

InChI=1S/C17H19BrN4O/c1-4-13(18)16-19-15-14(11(2)21(3)20-15)17(23)22(16)10-12-8-6-5-7-9-12/h5-9,13H,4,10H2,1-3H3