(2S)-3-methyl-2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]butanoic acid Openeye Name: (2S)-3-methyl-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]butanoic acid CAS Name: (2S)-3-methyl-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]butanoic acid IUPAC Name: (2S)-3-methyl-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]butanoic acid Traditional Name: (2S)-2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-3-methyl-butyric acid Formula: C10H14N2O3S MolecularWeight: 242.29476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=O)N=C(N1)S[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C10H14N2O3S/c1-5(2)8(9(14)15)16-10-11-6(3)4-7(13)12-10/h4-5,8H,1-3H3,(H,14,15)(H,11,12,13)/t8-/m0/s1