4-(5-butyl-3,4-dimethyl-1,3-thiazol-3-ium-2-yl)-N,N-dimethyl-aniline iodide

Systemtic Name: 4-(5-butyl-3,4-dimethyl-1,3-thiazol-3-ium-2-yl)-N,N-dimethyl-aniline iodide Openeye Name: 4-(5-butyl-3,4-dimethyl-thiazol-3-ium-2-yl)-N,N-dimethyl-aniline iodide CAS Name: 4-(5-butyl-3,4-dimethyl-2-thiazol-3-iumyl)-N,N-dimethylaniline iodide IUPAC Name: 4-(5-butyl-3,4-dimethyl-1,3-thiazol-3-ium-2-yl)-N,N-dimethylaniline iodide Traditional Name: [4-(5-butyl-3,4-dimethyl-thiazol-3-ium-2-yl)phenyl]-dimethyl-amine iodide Formula: C17H25IN2S MolecularWeight: 416.36327

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C([N+](=C(S1)C2=CC=C(C=C2)N(C)C)C)C.[I-]

Isomeric SMILES

CCCCC1=C([N+](=C(S1)C2=CC=C(C=C2)N(C)C)C)C.[I-]

InChI

InChI=1S/C17H25N2S.HI/c1-6-7-8-16-13(2)19(5)17(20-16)14-9-11-15(12-10-14)18(3)4;/h9-12H,6-8H2,1-5H3;1H/q+1;/p-1