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

Systemtic Name: N,N-diethyl-4-[3-hexyl-2-[(4-methoxyphenyl)amino]-1,3-thiazol-3-ium-4-yl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-hexyl-2-(4-methoxyanilino)thiazol-3-ium-4-yl]benzenesulfonamide CAS Name: N,N-diethyl-4-[3-hexyl-2-(4-methoxyanilino)-4-thiazol-3-iumyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-hexyl-2-(4-methoxyanilino)-1,3-thiazol-3-ium-4-yl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[3-hexyl-2-(p-anisidino)thiazol-3-ium-4-yl]benzenesulfonamide Formula: C26H36N3O3S2+ MolecularWeight: 502.71234

Click to see the large picture

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)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H35N3O3S2/c1-5-8-9-10-19-29-25(20-33-26(29)27-22-13-15-23(32-4)16-14-22)21-11-17-24(18-12-21)34(30,31)28(6-2)7-3/h11-18,20H,5-10,19H2,1-4H3/p+1