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

Systemtic Name: 3-propan-2-yl-6-(pyridin-4-ylmethyl)-1-[2,4,6-tris(chloranyl)phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3-isopropyl-6-(4-pyridylmethyl)-1-(2,4,6-trichlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3-propan-2-yl-6-(pyridin-4-ylmethyl)-1-(2,4,6-trichlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 3-propan-2-yl-6-(pyridin-4-ylmethyl)-1-(2,4,6-trichlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-isopropyl-6-(4-pyridylmethyl)-1-(2,4,6-trichlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H16Cl3N5O MolecularWeight: 448.73294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16Cl3N5O/c1-10(2)17-16-19(28(27-17)18-13(22)8-12(21)9-14(18)23)25-15(26-20(16)29)7-11-3-5-24-6-4-11/h3-6,8-10,27H,7H2,1-2H3