2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylpyridine-3-carboxylic acid Openeye Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylpyridine-3-carboxylic acid CAS Name: 2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]nicotinic acid Formula: C12H9N5O2S MolecularWeight: 287.29716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SC3=C(C=CC=N3)C(=O)O

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SC3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C12H9N5O2S/c1-17-9-8(5-16-17)11(15-6-14-9)20-10-7(12(18)19)3-2-4-13-10/h2-6H,1H3,(H,18,19)