[(2S)-2-[(4-acetamido-2-oxidanylidene-pyrimidin-1-yl)methoxy]-2-sulfanyl-ethyl] butanoate

Systemtic Name: [(2S)-2-[(4-acetamido-2-oxidanylidene-pyrimidin-1-yl)methoxy]-2-sulfanyl-ethyl] butanoate Openeye Name: [(2S)-2-[(4-acetamido-2-oxo-pyrimidin-1-yl)methoxy]-2-sulfanyl-ethyl] butanoate CAS Name: butanoic acid [(2S)-2-[(4-acetamido-2-oxo-1-pyrimidinyl)methoxy]-2-mercaptoethyl] ester IUPAC Name: [(2S)-2-[(4-acetamido-2-oxopyrimidin-1-yl)methoxy]-2-sulfanylethyl] butanoate Traditional Name: butyric acid [(2S)-2-[(4-acetamido-2-keto-pyrimidin-1-yl)methoxy]-2-mercapto-ethyl] ester Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(OCN1C=CC(=NC1=O)NC(=O)C)S

Isomeric SMILES

CCCC(=O)OC[C@@H](OCN1C=CC(=NC1=O)NC(=O)C)S

InChI

InChI=1S/C13H19N3O5S/c1-3-4-11(18)20-7-12(22)21-8-16-6-5-10(14-9(2)17)15-13(16)19/h5-6,12,22H,3-4,7-8H2,1-2H3,(H,14,15,17,19)/t12-/m0/s1