5-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(2-chloro-7,8-dimethyl-3-quinolinyl)methyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(2-chloro-7,8-dimethylquinolin-3-yl)methyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C23H18ClN5O MolecularWeight: 415.87492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5)Cl)C

InChI

InChI=1S/C23H18ClN5O/c1-14-8-9-16-10-17(21(24)27-20(16)15(14)2)12-28-13-25-22-19(23(28)30)11-26-29(22)18-6-4-3-5-7-18/h3-11,13H,12H2,1-2H3