2-(1-methylpyridin-1-ium-3-yl)-3-(phenylmethyl)-1,3-thiazolidin-4-one iodide

Systemtic Name: 2-(1-methylpyridin-1-ium-3-yl)-3-(phenylmethyl)-1,3-thiazolidin-4-one iodide Openeye Name: 3-benzyl-2-(1-methylpyridin-1-ium-3-yl)thiazolidin-4-one iodide CAS Name: 2-(1-methyl-3-pyridin-1-iumyl)-3-(phenylmethyl)-4-thiazolidinone iodide IUPAC Name: 3-benzyl-2-(1-methylpyridin-1-ium-3-yl)-1,3-thiazolidin-4-one iodide Traditional Name: 3-benzyl-2-(1-methylpyridin-1-ium-3-yl)thiazolidin-4-one iodide Formula: C16H17IN2OS MolecularWeight: 412.28845

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C2N(C(=O)CS2)CC3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C2N(C(=O)CS2)CC3=CC=CC=C3.[I-]

InChI

InChI=1S/C16H17N2OS.HI/c1-17-9-5-8-14(11-17)16-18(15(19)12-20-16)10-13-6-3-2-4-7-13;/h2-9,11,16H,10,12H2,1H3;1H/q+1;/p-1