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

Systemtic Name: 3-[(2S)-butan-2-yl]-2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-[2-(diethylamino)-2-oxo-ethyl]sulfanyl-5-ethyl-3-[(1S)-1-methylpropyl]-6-oxo-pyrimidin-4-olate CAS Name: 3-[(2S)-butan-2-yl]-2-[[2-(diethylamino)-2-oxoethyl]thio]-5-ethyl-6-oxo-4-pyrimidinolate IUPAC Name: 3-[(2S)-butan-2-yl]-2-[2-(diethylamino)-2-oxoethyl]sulfanyl-5-ethyl-6-oxopyrimidin-4-olate Traditional Name: 2-[[2-(diethylamino)-2-keto-ethyl]thio]-5-ethyl-6-keto-3-[(1S)-1-methylpropyl]pyrimidin-4-olate Formula: C16H26N3O3S- MolecularWeight: 340.46094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3O3S/c1-6-11(5)19-15(22)12(7-2)14(21)17-16(19)23-10-13(20)18(8-3)9-4/h11,22H,6-10H2,1-5H3/p-1/t11-/m0/s1