ethyl (2S)-2-(1-methyl-6-oxidanylidene-4-propan-2-yl-pyrimidin-2-yl)sulfanylpropanoate

Systemtic Name: ethyl (2S)-2-(1-methyl-6-oxidanylidene-4-propan-2-yl-pyrimidin-2-yl)sulfanylpropanoate Openeye Name: ethyl (2S)-2-(4-isopropyl-1-methyl-6-oxo-pyrimidin-2-yl)sulfanylpropanoate CAS Name: (2S)-2-[(1-methyl-6-oxo-4-propan-2-yl-2-pyrimidinyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(1-methyl-6-oxo-4-propan-2-ylpyrimidin-2-yl)sulfanylpropanoate Traditional Name: (2S)-2-[(4-isopropyl-6-keto-1-methyl-pyrimidin-2-yl)thio]propionic acid ethyl ester Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O3S/c1-6-18-12(17)9(4)19-13-14-10(8(2)3)7-11(16)15(13)5/h7-9H,6H2,1-5H3/t9-/m0/s1