6-[1-[(6-chloranylpyridin-3-yl)methyl-(2-dimethylaminoethyl)amino]propyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[1-[(6-chloranylpyridin-3-yl)methyl-(2-dimethylaminoethyl)amino]propyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-benzyl-6-[1-[(6-chloro-3-pyridyl)methyl-(2-dimethylaminoethyl)amino]propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[1-[(6-chloro-3-pyridinyl)methyl-(2-dimethylaminoethyl)amino]propyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 5-benzyl-6-[1-[(6-chloropyridin-3-yl)methyl-(2-dimethylaminoethyl)amino]propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-benzyl-6-[1-[(6-chloro-3-pyridyl)methyl-(2-dimethylaminoethyl)amino]propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H30ClN7O MolecularWeight: 480.005

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=NN2)C(=O)N1CC3=CC=CC=C3)N(CCN(C)C)CC4=CN=C(C=C4)Cl

Isomeric SMILES

CCC(C1=NC2=C(C=NN2)C(=O)N1CC3=CC=CC=C3)N(CCN(C)C)CC4=CN=C(C=C4)Cl

InChI

InChI=1S/C25H30ClN7O/c1-4-21(32(13-12-31(2)3)16-19-10-11-22(26)27-14-19)24-29-23-20(15-28-30-23)25(34)33(24)17-18-8-6-5-7-9-18/h5-11,14-15,21H,4,12-13,16-17H2,1-3H3,(H,28,30)