4-(4-ethyl-3-methyl-4-propyl-5H-1,3-thiazol-3-ium-2-yl)-N,N-dimethyl-aniline iodide

Systemtic Name: 4-(4-ethyl-3-methyl-4-propyl-5H-1,3-thiazol-3-ium-2-yl)-N,N-dimethyl-aniline iodide Openeye Name: 4-(4-ethyl-3-methyl-4-propyl-5H-thiazol-3-ium-2-yl)-N,N-dimethyl-aniline iodide CAS Name: 4-(4-ethyl-3-methyl-4-propyl-5H-thiazol-3-ium-2-yl)-N,N-dimethylaniline iodide IUPAC Name: 4-(4-ethyl-3-methyl-4-propyl-5H-1,3-thiazol-3-ium-2-yl)-N,N-dimethylaniline iodide Traditional Name: [4-(4-ethyl-3-methyl-4-propyl-2-thiazolin-3-ium-2-yl)phenyl]-dimethyl-amine iodide Formula: C17H27IN2S MolecularWeight: 418.37915

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CSC(=[N+]1C)C2=CC=C(C=C2)N(C)C)CC.[I-]

Isomeric SMILES

CCCC1(CSC(=[N+]1C)C2=CC=C(C=C2)N(C)C)CC.[I-]

InChI

InChI=1S/C17H27N2S.HI/c1-6-12-17(7-2)13-20-16(19(17)5)14-8-10-15(11-9-14)18(3)4;/h8-11H,6-7,12-13H2,1-5H3;1H/q+1;/p-1