6-[5-azanyl-1-(4-methoxyphenyl)pyrazol-4-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-[5-azanyl-1-(4-methoxyphenyl)pyrazol-4-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-[5-amino-1-(4-methoxyphenyl)pyrazol-4-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 6-[5-amino-1-(4-methoxyphenyl)-4-pyrazolyl]-1-(4-methoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 6-[5-amino-1-(4-methoxyphenyl)pyrazol-4-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [4-[4-amino-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]-2-(4-methoxyphenyl)pyrazol-3-yl]amine Formula: C22H20N8O2 MolecularWeight: 428.4466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=NN4C5=CC=C(C=C5)OC)C(=N3)N)N

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=NN4C5=CC=C(C=C5)OC)C(=N3)N)N

InChI

InChI=1S/C22H20N8O2/c1-31-15-7-3-13(4-8-15)29-20(24)18(12-25-29)21-27-19(23)17-11-26-30(22(17)28-21)14-5-9-16(32-2)10-6-14/h3-12H,24H2,1-2H3,(H2,23,27,28)