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

Systemtic Name: 3-ethyl-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-6-oxidanylidene-5-[(2S)-pentan-2-yl]pyrimidin-4-olate Openeye Name: 3-ethyl-5-[(1S)-1-methylbutyl]-2-(2-morpholino-2-oxo-ethyl)sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-ethyl-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-6-oxo-5-[(2S)-pentan-2-yl]-4-pyrimidinolate IUPAC Name: 3-ethyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-6-oxo-5-[(2S)-pentan-2-yl]pyrimidin-4-olate Traditional Name: 3-ethyl-6-keto-2-[(2-keto-2-morpholino-ethyl)thio]-5-[(1S)-1-methylbutyl]pyrimidin-4-olate Formula: C17H26N3O4S- MolecularWeight: 368.47104

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=C(N(C(=NC1=O)SCC(=O)N2CCOCC2)CC)[O-]

Isomeric SMILES

CCC[C@H](C)C1=C(N(C(=NC1=O)SCC(=O)N2CCOCC2)CC)[O-]

InChI

InChI=1S/C17H27N3O4S/c1-4-6-12(3)14-15(22)18-17(20(5-2)16(14)23)25-11-13(21)19-7-9-24-10-8-19/h12,23H,4-11H2,1-3H3/p-1/t12-/m0/s1