2-(4-tert-butyl-3-decoxy-phenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide chloride

Systemtic Name: 2-(4-tert-butyl-3-decoxy-phenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide chloride Openeye Name: 2-(4-tert-butyl-3-decoxy-phenyl)-N-[3-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride CAS Name: 2-(4-tert-butyl-3-decoxyphenyl)-N-[3-(3-methyl-2-thiazol-3-iumyl)phenyl]acetamide chloride IUPAC Name: 2-(4-tert-butyl-3-decoxyphenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]acetamide chloride Traditional Name: 2-(4-tert-butyl-3-decoxy-phenyl)-N-[3-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride Formula: C32H45ClN2O2S MolecularWeight: 557.2299

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=CC(=C1)CC(=O)NC2=CC=CC(=C2)C3=[N+](C=CS3)C)C(C)(C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCOC1=C(C=CC(=C1)CC(=O)NC2=CC=CC(=C2)C3=[N+](C=CS3)C)C(C)(C)C.[Cl-]

InChI

InChI=1S/C32H44N2O2S.ClH/c1-6-7-8-9-10-11-12-13-20-36-29-22-25(17-18-28(29)32(2,3)4)23-30(35)33-27-16-14-15-26(24-27)31-34(5)19-21-37-31;/h14-19,21-22,24H,6-13,20,23H2,1-5H3;1H