3-(1,3-benzodioxol-5-ylmethyl)-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-tert-butyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-tert-butylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (1-tert-butyl-3-piperonyl-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C17H19N5O2 MolecularWeight: 325.36506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=N1)CC3=CC4=C(C=C3)OCO4)C(=NC=N2)N

Isomeric SMILES

CC(C)(C)N1C2=C(C(=N1)CC3=CC4=C(C=C3)OCO4)C(=NC=N2)N

InChI

InChI=1S/C17H19N5O2/c1-17(2,3)22-16-14(15(18)19-8-20-16)11(21-22)6-10-4-5-12-13(7-10)24-9-23-12/h4-5,7-8H,6,9H2,1-3H3,(H2,18,19,20)