(2S)-2-[(6-tert-butyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoate

Systemtic Name: (2S)-2-[(6-tert-butyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoate Openeye Name: (2S)-2-[(6-tert-butyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoate CAS Name: (2S)-2-[(6-tert-butyl-4-oxo-1H-pyrimidin-2-yl)thio]propanoate IUPAC Name: (2S)-2-[(6-tert-butyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoate Traditional Name: (2S)-2-[(6-tert-butyl-4-keto-1H-pyrimidin-2-yl)thio]propionate Formula: C11H15N2O3S- MolecularWeight: 255.3134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NC(=O)C=C(N1)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)[O-])SC1=NC(=O)C=C(N1)C(C)(C)C

InChI

InChI=1S/C11H16N2O3S/c1-6(9(15)16)17-10-12-7(11(2,3)4)5-8(14)13-10/h5-6H,1-4H3,(H,15,16)(H,12,13,14)/p-1/t6-/m0/s1