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

Systemtic Name: (4-phenylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-yl]methanone trichloride Openeye Name: (4-phenylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-ylthiazolidin-3-ium-4-yl]methanone trichloride CAS Name: (4-phenyl-1-piperazin-4-iumyl)-[(4R)-2-(3-pyridin-1-iumyl)-4-thiazolidin-3-iumyl]methanone trichloride IUPAC Name: (4-phenylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-yl]methanone trichloride Traditional Name: (4-phenylpiperazin-4-ium-1-yl)-[(4R)-2-pyridin-1-ium-3-ylthiazolidin-3-ium-4-yl]methanone trichloride Formula: C19H25Cl3N4OS MolecularWeight: 463.852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2=CC=CC=C2)C(=O)C3CSC([NH2+]3)C4=C[NH+]=CC=C4.[Cl-].[Cl-].[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1C2=CC=CC=C2)C(=O)[C@@H]3CSC([NH2+]3)C4=C[NH+]=CC=C4.[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C19H22N4OS.3ClH/c24-19(17-14-25-18(21-17)15-5-4-8-20-13-15)23-11-9-22(10-12-23)16-6-2-1-3-7-16;;;/h1-8,13,17-18,21H,9-12,14H2;3*1H/t17-,18?;;;/m0.../s1