3,6-dimethyl-2-[4-(phenylmethyl)phthalazin-1-yl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3,6-dimethyl-2-[4-(phenylmethyl)phthalazin-1-yl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 2-(4-benzylphthalazin-1-yl)-3,6-dimethyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3,6-dimethyl-2-[4-(phenylmethyl)-1-phthalazinyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 2-(4-benzylphthalazin-1-yl)-3,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [2-(4-benzylphthalazin-1-yl)-3,6-dimethyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C22H19N7 MolecularWeight: 381.43316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=NN1C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5)C)N

Isomeric SMILES

CC1=C2C(=NC(=NC2=NN1C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5)C)N

InChI

InChI=1S/C22H19N7/c1-13-19-20(23)24-14(2)25-21(19)28-29(13)22-17-11-7-6-10-16(17)18(26-27-22)12-15-8-4-3-5-9-15/h3-11H,12H2,1-2H3,(H2,23,24,25,28)