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

Systemtic Name: N,N-diethyl-4-[3-(3-methoxypropyl)-2-[(4-methylphenyl)amino]-1,3-thiazol-3-ium-4-yl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-(3-methoxypropyl)-2-(4-methylanilino)thiazol-3-ium-4-yl]benzenesulfonamide CAS Name: N,N-diethyl-4-[3-(3-methoxypropyl)-2-(4-methylanilino)-4-thiazol-3-iumyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-(3-methoxypropyl)-2-(4-methylanilino)-1,3-thiazol-3-ium-4-yl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[3-(3-methoxypropyl)-2-(p-toluidino)thiazol-3-ium-4-yl]benzenesulfonamide Formula: C24H32N3O3S2+ MolecularWeight: 474.65918

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=[N+]2CCCOC)NC3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=[N+]2CCCOC)NC3=CC=C(C=C3)C

InChI

InChI=1S/C24H31N3O3S2/c1-5-26(6-2)32(28,29)22-14-10-20(11-15-22)23-18-31-24(27(23)16-7-17-30-4)25-21-12-8-19(3)9-13-21/h8-15,18H,5-7,16-17H2,1-4H3/p+1