1-(2,4-dimethyl-1,3-thiazol-5-yl)-3-piperidin-1-ium-1-yl-propan-1-one chloride

Systemtic Name: 1-(2,4-dimethyl-1,3-thiazol-5-yl)-3-piperidin-1-ium-1-yl-propan-1-one chloride Openeye Name: 1-(2,4-dimethylthiazol-5-yl)-3-piperidin-1-ium-1-yl-propan-1-one chloride CAS Name: 1-(2,4-dimethyl-5-thiazolyl)-3-(1-piperidin-1-iumyl)-1-propanone chloride IUPAC Name: 1-(2,4-dimethyl-1,3-thiazol-5-yl)-3-piperidin-1-ium-1-ylpropan-1-one chloride Traditional Name: 1-(2,4-dimethylthiazol-5-yl)-3-piperidin-1-ium-1-yl-propan-1-one chloride Formula: C13H21ClN2OS MolecularWeight: 288.83664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C(=O)CC[NH+]2CCCCC2.[Cl-]

Isomeric SMILES

CC1=C(SC(=N1)C)C(=O)CC[NH+]2CCCCC2.[Cl-]

InChI

InChI=1S/C13H20N2OS.ClH/c1-10-13(17-11(2)14-10)12(16)6-9-15-7-4-3-5-8-15;/h3-9H2,1-2H3;1H