2-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)sulfanylpropanoic acid

Systemtic Name: 2-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)sulfanylpropanoic acid Openeye Name: 2-(2-isopropyl-6-methyl-pyrimidin-4-yl)sulfanylpropanoic acid CAS Name: 2-[(6-methyl-2-propan-2-yl-4-pyrimidinyl)thio]propanoic acid IUPAC Name: 2-(6-methyl-2-propan-2-ylpyrimidin-4-yl)sulfanylpropanoic acid Traditional Name: 2-[(2-isopropyl-6-methyl-pyrimidin-4-yl)thio]propionic acid Formula: C11H16N2O2S MolecularWeight: 240.32194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O2S/c1-6(2)10-12-7(3)5-9(13-10)16-8(4)11(14)15/h5-6,8H,1-4H3,(H,14,15)