2-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-[4-(methylcarbamoyl)phenyl]benzamide

Systemtic Name: 2-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-[4-(methylcarbamoyl)phenyl]benzamide Openeye Name: 2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-[4-(methylcarbamoyl)phenyl]benzamide CAS Name: 2-chloro-5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]-N-[4-(methylcarbamoyl)phenyl]benzamide IUPAC Name: 2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-[4-(methylcarbamoyl)phenyl]benzamide Traditional Name: 2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-[4-(methylcarbamoyl)phenyl]benzamide Formula: C21H26ClN4O4S+ MolecularWeight: 465.97354

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)NC

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)NC

InChI

InChI=1S/C21H25ClN4O4S/c1-3-25-10-12-26(13-11-25)31(29,30)17-8-9-19(22)18(14-17)21(28)24-16-6-4-15(5-7-16)20(27)23-2/h4-9,14H,3,10-13H2,1-2H3,(H,23,27)(H,24,28)/p+1