2-(4-methyl-2-propyl-pyrazolo[3,4-b]pyridin-6-yl)sulfanylethanoate

Systemtic Name: 2-(4-methyl-2-propyl-pyrazolo[3,4-b]pyridin-6-yl)sulfanylethanoate Openeye Name: 2-(4-methyl-2-propyl-pyrazolo[3,4-b]pyridin-6-yl)sulfanylacetate CAS Name: 2-[(4-methyl-2-propyl-6-pyrazolo[3,4-b]pyridinyl)thio]acetate IUPAC Name: 2-(4-methyl-2-propylpyrazolo[3,4-b]pyridin-6-yl)sulfanylacetate Traditional Name: 2-[(4-methyl-2-propyl-pyrazolo[3,4-b]pyridin-6-yl)thio]acetate Formula: C12H14N3O2S- MolecularWeight: 264.32346

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C2C(=CC(=NC2=N1)SCC(=O)[O-])C

Isomeric SMILES

CCCN1C=C2C(=CC(=NC2=N1)SCC(=O)[O-])C

InChI

InChI=1S/C12H15N3O2S/c1-3-4-15-6-9-8(2)5-10(13-12(9)14-15)18-7-11(16)17/h5-6H,3-4,7H2,1-2H3,(H,16,17)/p-1