2-[(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(6-isopropyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetic acid CAS Name: 2-[(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)thio]acetic acid IUPAC Name: 2-[(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(6-isopropyl-4-keto-1H-pyrimidin-2-yl)thio]acetic acid Formula: C9H12N2O3S MolecularWeight: 228.26818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N=C(N1)SCC(=O)O

Isomeric SMILES

CC(C)C1=CC(=O)N=C(N1)SCC(=O)O

InChI

InChI=1S/C9H12N2O3S/c1-5(2)6-3-7(12)11-9(10-6)15-4-8(13)14/h3,5H,4H2,1-2H3,(H,13,14)(H,10,11,12)