5-[(5-bromanyl-2-methoxy-phenyl)methyl]-3-pyridin-3-yl-1,4-dihydropyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[(5-bromanyl-2-methoxy-phenyl)methyl]-3-pyridin-3-yl-1,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[(5-bromo-2-methoxy-phenyl)methyl]-3-(3-pyridyl)-1,4-dihydropyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[(5-bromo-2-methoxyphenyl)methyl]-3-(3-pyridinyl)-1,4-dihydropyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[(5-bromo-2-methoxyphenyl)methyl]-3-pyridin-3-yl-1,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(5-bromo-2-methoxy-benzyl)-3-(3-pyridyl)-1,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Formula: C18H14BrN5O2 MolecularWeight: 412.24006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CC2=NC(=O)C3=C(N2)C(=NN3)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CC2=NC(=O)C3=C(N2)C(=NN3)C4=CN=CC=C4

InChI

InChI=1S/C18H14BrN5O2/c1-26-13-5-4-12(19)7-11(13)8-14-21-16-15(10-3-2-6-20-9-10)23-24-17(16)18(25)22-14/h2-7,9H,8H2,1H3,(H,23,24)(H,21,22,25)