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

Systemtic Name: 3-methyl-6-phenyl-2-[4-(phenylmethyl)phthalazin-1-yl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 2-(4-benzylphthalazin-1-yl)-3-methyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-methyl-6-phenyl-2-[4-(phenylmethyl)-1-phthalazinyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 2-(4-benzylphthalazin-1-yl)-3-methyl-6-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [2-(4-benzylphthalazin-1-yl)-3-methyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C27H21N7 MolecularWeight: 443.50254

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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)C6=CC=CC=C6)N

Isomeric SMILES

CC1=C2C(=NC(=NC2=NN1C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5)C6=CC=CC=C6)N

InChI

InChI=1S/C27H21N7/c1-17-23-24(28)29-25(19-12-6-3-7-13-19)30-26(23)33-34(17)27-21-15-9-8-14-20(21)22(31-32-27)16-18-10-4-2-5-11-18/h2-15H,16H2,1H3,(H2,28,29,30,33)