methyl (2R)-2-(4-tert-butyl-1-methyl-6-oxidanylidene-pyrimidin-2-yl)sulfanylpropanoate

Systemtic Name: methyl (2R)-2-(4-tert-butyl-1-methyl-6-oxidanylidene-pyrimidin-2-yl)sulfanylpropanoate Openeye Name: methyl (2R)-2-(4-tert-butyl-1-methyl-6-oxo-pyrimidin-2-yl)sulfanylpropanoate CAS Name: (2R)-2-[(4-tert-butyl-1-methyl-6-oxo-2-pyrimidinyl)thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-(4-tert-butyl-1-methyl-6-oxopyrimidin-2-yl)sulfanylpropanoate Traditional Name: (2R)-2-[(4-tert-butyl-6-keto-1-methyl-pyrimidin-2-yl)thio]propionic acid methyl ester Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NC(=CC(=O)N1C)C(C)(C)C

Isomeric SMILES

C[C@H](C(=O)OC)SC1=NC(=CC(=O)N1C)C(C)(C)C

InChI

InChI=1S/C13H20N2O3S/c1-8(11(17)18-6)19-12-14-9(13(2,3)4)7-10(16)15(12)5/h7-8H,1-6H3/t8-/m1/s1