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

Systemtic Name: N,N-diethyl-4-[3-ethyl-2-[(4-methylphenyl)amino]-1,3-thiazol-3-ium-4-yl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-ethyl-2-(4-methylanilino)thiazol-3-ium-4-yl]benzenesulfonamide CAS Name: N,N-diethyl-4-[3-ethyl-2-(4-methylanilino)-4-thiazol-3-iumyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-ethyl-2-(4-methylanilino)-1,3-thiazol-3-ium-4-yl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[3-ethyl-2-(p-toluidino)thiazol-3-ium-4-yl]benzenesulfonamide Formula: C22H28N3O2S2+ MolecularWeight: 430.60662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S2/c1-5-24(6-2)29(26,27)20-14-10-18(11-15-20)21-16-28-22(25(21)7-3)23-19-12-8-17(4)9-13-19/h8-16H,5-7H2,1-4H3/p+1