4-[(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)methyl]thiazole-2-carboxylic acid Formula: C11H9N5O3S MolecularWeight: 291.28586

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC3=CSC(=N3)C(=O)O

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C11H9N5O3S/c1-15-8-7(2-13-15)10(17)16(5-12-8)3-6-4-20-9(14-6)11(18)19/h2,4-5H,3H2,1H3,(H,18,19)