5-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]-1-methyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C15H13ClN4O3 MolecularWeight: 332.74172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C15H13ClN4O3/c1-19-14-10(6-18-19)15(22)20(8-17-14)7-12(21)9-3-4-13(23-2)11(16)5-9/h3-6,8H,7H2,1-2H3