3-(4-phenoxyphenyl)-1-[3-(phenylmethoxymethyl)cyclobutyl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-(4-phenoxyphenyl)-1-[3-(phenylmethoxymethyl)cyclobutyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-[3-(benzyloxymethyl)cyclobutyl]-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(4-phenoxyphenyl)-1-[3-(phenylmethoxymethyl)cyclobutyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-(4-phenoxyphenyl)-1-[3-(phenylmethoxymethyl)cyclobutyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-[3-(benzoxymethyl)cyclobutyl]-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C29H27N5O2 MolecularWeight: 477.55698

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC1N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=NC=N3)N)COCC6=CC=CC=C6

Isomeric SMILES

C1C(CC1N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=NC=N3)N)COCC6=CC=CC=C6

InChI

InChI=1S/C29H27N5O2/c30-28-26-27(22-11-13-25(14-12-22)36-24-9-5-2-6-10-24)33-34(29(26)32-19-31-28)23-15-21(16-23)18-35-17-20-7-3-1-4-8-20/h1-14,19,21,23H,15-18H2,(H2,30,31,32)