N,N-diethyl-4-(3-hexyl-2-phenylazanyl-1,3-thiazol-3-ium-4-yl)benzenesulfonamide

Systemtic Name: N,N-diethyl-4-(3-hexyl-2-phenylazanyl-1,3-thiazol-3-ium-4-yl)benzenesulfonamide Openeye Name: 4-(2-anilino-3-hexyl-thiazol-3-ium-4-yl)-N,N-diethyl-benzenesulfonamide CAS Name: 4-(2-anilino-3-hexyl-4-thiazol-3-iumyl)-N,N-diethylbenzenesulfonamide IUPAC Name: 4-(2-anilino-3-hexyl-1,3-thiazol-3-ium-4-yl)-N,N-diethylbenzenesulfonamide Traditional Name: 4-(2-anilino-3-hexyl-thiazol-3-ium-4-yl)-N,N-diethyl-benzenesulfonamide Formula: C25H34N3O2S2+ MolecularWeight: 472.68636

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O2S2/c1-4-7-8-12-19-28-24(20-31-25(28)26-22-13-10-9-11-14-22)21-15-17-23(18-16-21)32(29,30)27(5-2)6-3/h9-11,13-18,20H,4-8,12,19H2,1-3H3/p+1