2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-propyl-pyrimidin-4-olate

Systemtic Name: 2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-propyl-pyrimidin-4-olate Openeye Name: 2-[2-(diethylamino)-2-oxo-ethyl]sulfanyl-5-ethyl-6-propyl-pyrimidin-4-olate CAS Name: 2-[[2-(diethylamino)-2-oxoethyl]thio]-5-ethyl-6-propyl-4-pyrimidinolate IUPAC Name: 2-[2-(diethylamino)-2-oxoethyl]sulfanyl-5-ethyl-6-propylpyrimidin-4-olate Traditional Name: 2-[[2-(diethylamino)-2-keto-ethyl]thio]-5-ethyl-6-propyl-pyrimidin-4-olate Formula: C15H24N3O2S- MolecularWeight: 310.43496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NC(=N1)SCC(=O)N(CC)CC)[O-])CC

Isomeric SMILES

CCCC1=C(C(=NC(=N1)SCC(=O)N(CC)CC)[O-])CC

InChI

InChI=1S/C15H25N3O2S/c1-5-9-12-11(6-2)14(20)17-15(16-12)21-10-13(19)18(7-3)8-4/h5-10H2,1-4H3,(H,16,17,20)/p-1