N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[3-(phenylsulfonylamino)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[3-(phenylsulfonylamino)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[3-(benzenesulfonamido)benzoyl]piperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[4-[[3-(benzenesulfonamido)phenyl]-oxomethyl]-1-piperazin-1-iumyl]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[4-[3-(benzenesulfonamido)benzoyl]piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[4-[3-(benzenesulfonamido)benzoyl]piperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)acetamide Formula: C23H26N5O5S+ MolecularWeight: 484.54804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H25N5O5S/c1-17-14-21(25-33-17)24-22(29)16-27-10-12-28(13-11-27)23(30)18-6-5-7-19(15-18)26-34(31,32)20-8-3-2-4-9-20/h2-9,14-15,26H,10-13,16H2,1H3,(H,24,25,29)/p+1