2-(2,4-dimethyl-4-oxidanyl-6-sulfanyl-1H-pyrimidin-5-yl)ethanoate

Systemtic Name: 2-(2,4-dimethyl-4-oxidanyl-6-sulfanyl-1H-pyrimidin-5-yl)ethanoate Openeye Name: 2-(4-hydroxy-2,4-dimethyl-6-sulfanyl-1H-pyrimidin-5-yl)acetate CAS Name: 2-(4-hydroxy-6-mercapto-2,4-dimethyl-1H-pyrimidin-5-yl)acetate IUPAC Name: 2-(4-hydroxy-2,4-dimethyl-6-sulfanyl-1H-pyrimidin-5-yl)acetate Traditional Name: 2-(4-hydroxy-6-mercapto-2,4-dimethyl-1H-pyrimidin-5-yl)acetate Formula: C8H11N2O3S- MolecularWeight: 215.24954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C(=C(N1)S)CC(=O)[O-])(C)O

Isomeric SMILES

CC1=NC(C(=C(N1)S)CC(=O)[O-])(C)O

InChI

InChI=1S/C8H12N2O3S/c1-4-9-7(14)5(3-6(11)12)8(2,13)10-4/h13-14H,3H2,1-2H3,(H,9,10)(H,11,12)/p-1