bis[2-(3-ethyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethyl] butanedioate diiodide

Systemtic Name: bis[2-(3-ethyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethyl] butanedioate diiodide Openeye Name: bis[2-(3-ethyl-4-methyl-thiazol-3-ium-5-yl)ethyl] butanedioate diiodide CAS Name: butanedioic acid bis[2-(3-ethyl-4-methyl-5-thiazol-3-iumyl)ethyl] ester diiodide IUPAC Name: bis[2-(3-ethyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethyl] butanedioate diiodide Traditional Name: succinic acid bis[2-(3-ethyl-4-methyl-thiazol-3-ium-5-yl)ethyl] ester diiodide Formula: C20H30I2N2O4S2 MolecularWeight: 680.40214

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CSC(=C1C)CCOC(=O)CCC(=O)OCCC2=C([N+](=CS2)CC)C.[I-].[I-]

Isomeric SMILES

CC[N+]1=CSC(=C1C)CCOC(=O)CCC(=O)OCCC2=C([N+](=CS2)CC)C.[I-].[I-]

InChI

InChI=1S/C20H30N2O4S2.2HI/c1-5-21-13-27-17(15(21)3)9-11-25-19(23)7-8-20(24)26-12-10-18-16(4)22(6-2)14-28-18;;/h13-14H,5-12H2,1-4H3;2*1H/q+2;;/p-2