4-[(4-tert-butyl-3-ethyl-1,3-thiazol-3-ium-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide bromide

Systemtic Name: 4-[(4-tert-butyl-3-ethyl-1,3-thiazol-3-ium-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide bromide Openeye Name: 4-[(4-tert-butyl-3-ethyl-thiazol-3-ium-2-yl)amino]-N-(5-methylisoxazol-3-yl)benzenesulfonamide bromide CAS Name: 4-[(4-tert-butyl-3-ethyl-2-thiazol-3-iumyl)amino]-N-(5-methyl-3-isoxazolyl)benzenesulfonamide bromide IUPAC Name: 4-[(4-tert-butyl-3-ethyl-1,3-thiazol-3-ium-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide bromide Traditional Name: 4-[(4-tert-butyl-3-ethyl-thiazol-3-ium-2-yl)amino]-N-(5-methylisoxazol-3-yl)benzenesulfonamide bromide Formula: C19H25BrN4O3S2 MolecularWeight: 501.4608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC=C1C(C)(C)C)NC2=CC=C(C=C2)S(=O)(=O)NC3=NOC(=C3)C.[Br-]

Isomeric SMILES

CC[N+]1=C(SC=C1C(C)(C)C)NC2=CC=C(C=C2)S(=O)(=O)NC3=NOC(=C3)C.[Br-]

InChI

InChI=1S/C19H24N4O3S2.BrH/c1-6-23-16(19(3,4)5)12-27-18(23)20-14-7-9-15(10-8-14)28(24,25)22-17-11-13(2)26-21-17;/h7-12H,6H2,1-5H3,(H,21,22);1H