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

Systemtic Name: 6-(5-bromanyl-2-propoxy-phenyl)-3-methyl-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(5-bromo-2-propoxy-phenyl)-3-methyl-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(5-bromo-2-propoxyphenyl)-3-methyl-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(5-bromo-2-propoxyphenyl)-3-methyl-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(5-bromo-2-propoxy-phenyl)-3-methyl-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H21BrN4O2 MolecularWeight: 405.28894

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC(=NC(=O)C2=C(N1)C)C3=C(C=CC(=C3)Br)OCCC

Isomeric SMILES

CCCN1C2=NC(=NC(=O)C2=C(N1)C)C3=C(C=CC(=C3)Br)OCCC

InChI

InChI=1S/C18H21BrN4O2/c1-4-8-23-17-15(11(3)22-23)18(24)21-16(20-17)13-10-12(19)6-7-14(13)25-9-5-2/h6-7,10,22H,4-5,8-9H2,1-3H3