5-(2,3-dimethyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-methyl-pyridine-3-sulfinate

Systemtic Name: 5-(2,3-dimethyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-methyl-pyridine-3-sulfinate Openeye Name: 5-(2,3-dimethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-methyl-pyridine-3-sulfinate CAS Name: 5-(2,3-dimethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-methyl-3-pyridinesulfinate IUPAC Name: 5-(2,3-dimethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-methylpyridine-3-sulfinate Traditional Name: 5-(7-keto-2,3-dimethyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-methyl-pyridine-3-sulfinate Formula: C13H12N5O3S- MolecularWeight: 318.33108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN1C)C(=O)N=C(N2)C3=CC(=CN=C3C)S(=O)[O-]

Isomeric SMILES

CC1=C2C(=NN1C)C(=O)N=C(N2)C3=CC(=CN=C3C)S(=O)[O-]

InChI

InChI=1S/C13H13N5O3S/c1-6-9(4-8(5-14-6)22(20)21)12-15-10-7(2)18(3)17-11(10)13(19)16-12/h4-5H,1-3H3,(H,20,21)(H,15,16,19)/p-1