N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(diethylsulfamoyl)benzamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(diethylsulfamoyl)benzamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(diethylsulfamoyl)benzamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-(diethylsulfamoyl)benzamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(diethylsulfamoyl)benzamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(diethylsulfamoyl)benzamide Formula: C22H30ClN4O3S+ MolecularWeight: 466.0166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)Cl)N3CC[NH+](CC3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)Cl)N3CC[NH+](CC3)C

InChI

InChI=1S/C22H29ClN4O3S/c1-4-27(5-2)31(29,30)19-8-6-7-17(15-19)22(28)24-20-16-18(23)9-10-21(20)26-13-11-25(3)12-14-26/h6-10,15-16H,4-5,11-14H2,1-3H3,(H,24,28)/p+1