3-[(2R)-butan-2-yl]-2-[(2S)-butan-2-yl]sulfanyl-5-ethyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 3-[(2R)-butan-2-yl]-2-[(2S)-butan-2-yl]sulfanyl-5-ethyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 5-ethyl-3-[(1R)-1-methylpropyl]-2-[(1S)-1-methylpropyl]sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-[(2R)-butan-2-yl]-2-[[(2S)-butan-2-yl]thio]-5-ethyl-6-oxo-4-pyrimidinolate IUPAC Name: 3-[(2R)-butan-2-yl]-2-[(2S)-butan-2-yl]sulfanyl-5-ethyl-6-oxopyrimidin-4-olate Traditional Name: 5-ethyl-6-keto-3-[(1R)-1-methylpropyl]-2-[[(1S)-1-methylpropyl]thio]pyrimidin-4-olate Formula: C14H23N2O2S- MolecularWeight: 283.40962

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SC(C)CC)C(C)CC)[O-]

Isomeric SMILES

CCC1=C(N(C(=NC1=O)S[C@@H](C)CC)[C@H](C)CC)[O-]

InChI

InChI=1S/C14H24N2O2S/c1-6-9(4)16-13(18)11(8-3)12(17)15-14(16)19-10(5)7-2/h9-10,18H,6-8H2,1-5H3/p-1/t9-,10+/m1/s1