3-methyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butanoic acid

Systemtic Name: 3-methyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butanoic acid Openeye Name: 3-methyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butanoic acid CAS Name: 3-methyl-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]butanoic acid IUPAC Name: 3-methyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butanoic acid Traditional Name: 3-methyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butyric acid Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC1=NC=NC2=C1C=NN2C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)O)NC1=NC=NC2=C1C=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H17N5O2/c1-10(2)13(16(22)23)20-14-12-8-19-21(15(12)18-9-17-14)11-6-4-3-5-7-11/h3-10,13H,1-2H3,(H,22,23)(H,17,18,20)