1-tert-butyl-3-(naphthalen-1-yloxymethyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-tert-butyl-3-(naphthalen-1-yloxymethyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-tert-butyl-3-(1-naphthyloxymethyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-tert-butyl-3-(1-naphthalenyloxymethyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-tert-butyl-3-(naphthalen-1-yloxymethyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-tert-butyl-3-(1-naphthoxymethyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=N1)COC3=CC=CC4=CC=CC=C43)C(=NC=N2)N

Isomeric SMILES

CC(C)(C)N1C2=C(C(=N1)COC3=CC=CC4=CC=CC=C43)C(=NC=N2)N

InChI

InChI=1S/C20H21N5O/c1-20(2,3)25-19-17(18(21)22-12-23-19)15(24-25)11-26-16-10-6-8-13-7-4-5-9-14(13)16/h4-10,12H,11H2,1-3H3,(H2,21,22,23)