5-(5-bromanyl-2-propoxy-phenyl)-1-ethyl-3-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-(5-bromanyl-2-propoxy-phenyl)-1-ethyl-3-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(5-bromo-2-propoxy-phenyl)-1-ethyl-3-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(5-bromo-2-propoxyphenyl)-1-ethyl-3-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(5-bromo-2-propoxyphenyl)-1-ethyl-3-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(5-bromo-2-propoxy-phenyl)-1-ethyl-3-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C17H19BrN4O2 MolecularWeight: 391.26236

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C2=NC(=O)C3=C(N2)C(=NN3CC)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C2=NC(=O)C3=C(N2)C(=NN3CC)C

InChI

InChI=1S/C17H19BrN4O2/c1-4-8-24-13-7-6-11(18)9-12(13)16-19-14-10(3)21-22(5-2)15(14)17(23)20-16/h6-7,9H,4-5,8H2,1-3H3,(H,19,20,23)