(4-methylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-yl]methanone trichloride

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-yl]methanone trichloride Openeye Name: (4-methylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-ylthiazolidin-3-ium-4-yl]methanone trichloride CAS Name: (4-methyl-1-piperazin-4-iumyl)-[(4R)-2-(3-pyridin-1-iumyl)-4-thiazolidin-3-iumyl]methanone trichloride IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-yl]methanone trichloride Traditional Name: (4-methylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-ylthiazolidin-3-ium-4-yl]methanone trichloride Formula: C14H23Cl3N4OS MolecularWeight: 401.78262

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2CSC([NH2+]2)C3=C[NH+]=CC=C3.[Cl-].[Cl-].[Cl-]

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)[C@@H]2CSC([NH2+]2)C3=C[NH+]=CC=C3.[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C14H20N4OS.3ClH/c1-17-5-7-18(8-6-17)14(19)12-10-20-13(16-12)11-3-2-4-15-9-11;;;/h2-4,9,12-13,16H,5-8,10H2,1H3;3*1H/t12-,13?;;;/m0.../s1