6-(5-bromanyl-2-propoxy-phenyl)-1,3-dimethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-(5-bromanyl-2-propoxy-phenyl)-1,3-dimethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(5-bromo-2-propoxy-phenyl)-1,3-dimethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(5-bromo-2-propoxyphenyl)-1,3-dimethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(5-bromo-2-propoxyphenyl)-1,3-dimethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(5-bromo-2-propoxy-phenyl)-1,3-dimethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H17BrN4O2 MolecularWeight: 377.23578

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C2=NC(=O)C3=C(NN(C3=N2)C)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C2=NC(=O)C3=C(NN(C3=N2)C)C

InChI

InChI=1S/C16H17BrN4O2/c1-4-7-23-12-6-5-10(17)8-11(12)14-18-15-13(16(22)19-14)9(2)20-21(15)3/h5-6,8,20H,4,7H2,1-3H3