2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-bis(methylsulfanyl)propanoic acid

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-bis(methylsulfanyl)propanoic acid Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-bis(methylsulfanyl)propanoic acid CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-3,3-bis(methylthio)propanoic acid IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-bis(methylsulfanyl)propanoic acid Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-3,3-bis(methylthio)propionic acid Formula: C11H16N2O4S3 MolecularWeight: 336.45074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SC(C(SC)SC)C(=O)O)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SC(C(SC)SC)C(=O)O)OC

InChI

InChI=1S/C11H16N2O4S3/c1-16-6-5-7(17-2)13-11(12-6)20-8(9(14)15)10(18-3)19-4/h5,8,10H,1-4H3,(H,14,15)