N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxyacetamide Traditional Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-N-piperonyl-acetamide Formula: C21H17N5O4 MolecularWeight: 403.39078

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C21H17N5O4/c27-19(22-9-14-6-7-17-18(8-14)30-13-29-17)11-28-21-16-10-25-26(20(16)23-12-24-21)15-4-2-1-3-5-15/h1-8,10,12H,9,11,13H2,(H,22,27)