ethyl 4-methyl-2-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)thiazole-5-carboxylate CAS Name: 4-methyl-2-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C12H11N5O3S MolecularWeight: 305.31244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N2C3=NC=NC(=O)C3=CN2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N2C3=NC=NC(=O)C3=CN2)C

InChI

InChI=1S/C12H11N5O3S/c1-3-20-11(19)8-6(2)16-12(21-8)17-9-7(4-15-17)10(18)14-5-13-9/h4-5,15H,3H2,1-2H3