2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-pyrrolidin-1-yl-ethanone dichloride

Systemtic Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-pyrrolidin-1-yl-ethanone dichloride Openeye Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-pyrrolidin-1-yl-ethanone dichloride CAS Name: 2-(4,5-dimethyl-3-thiazol-3-iumyl)-1-(1-pyrrolidinyl)ethanone dichloride IUPAC Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-pyrrolidin-1-ylethanone dichloride Traditional Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-pyrrolidino-ethanone dichloride Formula: C22H34Cl2N4O2S2 MolecularWeight: 521.56696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC(=O)N2CCCC2)C.CC1=C(SC=[N+]1CC(=O)N2CCCC2)C.[Cl-].[Cl-]

Isomeric SMILES

CC1=C(SC=[N+]1CC(=O)N2CCCC2)C.CC1=C(SC=[N+]1CC(=O)N2CCCC2)C.[Cl-].[Cl-]

InChI

InChI=1S/2C11H17N2OS.2ClH/c2*1-9-10(2)15-8-13(9)7-11(14)12-5-3-4-6-12;;/h2*8H,3-7H2,1-2H3;2*1H/q2*+1;;/p-2