1,3-bis(2-hydroxyethyl)-4,6-dimethyl-1,4-dihydropyrimidin-1-ium-2-thione; hydron; sulfate

Systemtic Name: 1,3-bis(2-hydroxyethyl)-4,6-dimethyl-1,4-dihydropyrimidin-1-ium-2-thione; hydron; sulfate Openeye Name: 1,3-bis(2-hydroxyethyl)-4,6-dimethyl-1,4-dihydropyrimidin-1-ium-2-thione; hydron; sulfate CAS Name: 1,3-bis(2-hydroxyethyl)-4,6-dimethyl-1,4-dihydropyrimidin-1-ium-2-thione; hydron; sulfate IUPAC Name: 1,3-bis(2-hydroxyethyl)-4,6-dimethyl-1,4-dihydropyrimidin-1-ium-2-thione; hydron; sulfate Traditional Name: 1,3-bis(2-hydroxyethyl)-4,6-dimethyl-1,4-dihydropyrimidin-1-ium-2-thione; hydron; sulfate Formula: C10H20N2O6S2 MolecularWeight: 328.4056

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Descriptors Computed from Structure

Canonical SMILES:

[H+].CC1C=C([NH+](C(=S)N1CCO)CCO)C.[O-]S(=O)(=O)[O-]

Isomeric SMILES

[H+].CC1C=C([NH+](C(=S)N1CCO)CCO)C.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C10H18N2O2S.H2O4S/c1-8-7-9(2)12(4-6-14)10(15)11(8)3-5-13;1-5(2,3)4/h7-8,13-14H,3-6H2,1-2H3;(H2,1,2,3,4)