6-[(4-dimethylaminophenyl)methyl]-3-propan-2-yl-1-[2,4,6-tris(chloranyl)phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(4-dimethylaminophenyl)methyl]-3-propan-2-yl-1-[2,4,6-tris(chloranyl)phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(4-dimethylaminophenyl)methyl]-3-isopropyl-1-(2,4,6-trichlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(4-dimethylaminophenyl)methyl]-3-propan-2-yl-1-(2,4,6-trichlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(4-dimethylaminophenyl)methyl]-3-propan-2-yl-1-(2,4,6-trichlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[4-(dimethylamino)benzyl]-3-isopropyl-1-(2,4,6-trichlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C23H22Cl3N5O MolecularWeight: 490.81268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=NC(=NC2=O)CC3=CC=C(C=C3)N(C)C)N(N1)C4=C(C=C(C=C4Cl)Cl)Cl

Isomeric SMILES

CC(C)C1=C2C(=NC(=NC2=O)CC3=CC=C(C=C3)N(C)C)N(N1)C4=C(C=C(C=C4Cl)Cl)Cl

InChI

InChI=1S/C23H22Cl3N5O/c1-12(2)20-19-22(31(29-20)21-16(25)10-14(24)11-17(21)26)27-18(28-23(19)32)9-13-5-7-15(8-6-13)30(3)4/h5-8,10-12,29H,9H2,1-4H3