4-[2-[(4-ethoxyphenyl)amino]-3-hexyl-1,3-thiazol-3-ium-4-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[2-[(4-ethoxyphenyl)amino]-3-hexyl-1,3-thiazol-3-ium-4-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[2-(4-ethoxyanilino)-3-hexyl-thiazol-3-ium-4-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[2-(4-ethoxyanilino)-3-hexyl-4-thiazol-3-iumyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[2-(4-ethoxyanilino)-3-hexyl-1,3-thiazol-3-ium-4-yl]-N,N-diethylbenzenesulfonamide Traditional Name: N,N-diethyl-4-[3-hexyl-2-(p-phenetidino)thiazol-3-ium-4-yl]benzenesulfonamide Formula: C27H38N3O3S2+ MolecularWeight: 516.73892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1=C(SC=C1C2=CC=C(C=C2)S(=O)(=O)N(CC)CC)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCC[N+]1=C(SC=C1C2=CC=C(C=C2)S(=O)(=O)N(CC)CC)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C27H37N3O3S2/c1-5-9-10-11-20-30-26(21-34-27(30)28-23-14-16-24(17-15-23)33-8-4)22-12-18-25(19-13-22)35(31,32)29(6-2)7-3/h12-19,21H,5-11,20H2,1-4H3/p+1