2-chloranyl-5-[(3,4-dimethylphenyl)sulfamoyl]-N-(4-methylpiperazin-4-ium-1-yl)benzamide

Systemtic Name: 2-chloranyl-5-[(3,4-dimethylphenyl)sulfamoyl]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Openeye Name: 2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]-N-(4-methylpiperazin-4-ium-1-yl)benzamide CAS Name: 2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]-N-(4-methyl-1-piperazin-4-iumyl)benzamide IUPAC Name: 2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Traditional Name: 2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Formula: C20H26ClN4O3S+ MolecularWeight: 437.96344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NN3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NN3CC[NH+](CC3)C)C

InChI

InChI=1S/C20H25ClN4O3S/c1-14-4-5-16(12-15(14)2)23-29(27,28)17-6-7-19(21)18(13-17)20(26)22-25-10-8-24(3)9-11-25/h4-7,12-13,23H,8-11H2,1-3H3,(H,22,26)/p+1