2-(4,6-dimethylpyrimidin-2-yl)ethanethioic S-acid

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)ethanethioic S-acid Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)ethanethioic S-acid CAS Name: 2-(4,6-dimethyl-2-pyrimidinyl)ethanethioic S-acid IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)ethanethioic S-acid Traditional Name: 2-(4,6-dimethylpyrimidin-2-yl)thioacetic acid Formula: C8H10N2OS MolecularWeight: 182.2428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)CC(=O)S)C

Isomeric SMILES

CC1=CC(=NC(=N1)CC(=O)S)C

InChI

InChI=1S/C8H10N2OS/c1-5-3-6(2)10-7(9-5)4-8(11)12/h3H,4H2,1-2H3,(H,11,12)