N-[2-chloranyl-5-[ethyl(phenyl)sulfamoyl]phenyl]-2-(4-methylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-chloranyl-5-[ethyl(phenyl)sulfamoyl]phenyl]-2-(4-methylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-chloro-5-[ethyl(phenyl)sulfamoyl]phenyl]-2-(4-methylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[2-chloro-5-[ethyl(phenyl)sulfamoyl]phenyl]-2-(4-methyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[2-chloro-5-[ethyl(phenyl)sulfamoyl]phenyl]-2-(4-methylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[2-chloro-5-[ethyl(phenyl)sulfamoyl]phenyl]-2-(4-methylpiperazin-1-ium-1-yl)acetamide Formula: C21H28ClN4O3S+ MolecularWeight: 451.99002

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C[NH+]3CCN(CC3)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C[NH+]3CCN(CC3)C

InChI

InChI=1S/C21H27ClN4O3S/c1-3-26(17-7-5-4-6-8-17)30(28,29)18-9-10-19(22)20(15-18)23-21(27)16-25-13-11-24(2)12-14-25/h4-10,15H,3,11-14,16H2,1-2H3,(H,23,27)/p+1