2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]hexanoic acid

Systemtic Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]hexanoic acid Openeye Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]hexanoic acid CAS Name: 2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]hexanoic acid IUPAC Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]hexanoic acid Traditional Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]hexanoic acid Formula: C12H17N5O2 MolecularWeight: 263.29568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC1=NC=NC2=C1C=NN2C

Isomeric SMILES

CCCCC(C(=O)O)NC1=NC=NC2=C1C=NN2C

InChI

InChI=1S/C12H17N5O2/c1-3-4-5-9(12(18)19)16-10-8-6-15-17(2)11(8)14-7-13-10/h6-7,9H,3-5H2,1-2H3,(H,18,19)(H,13,14,16)