2-chloranyl-N-(3-chloranyl-4-methyl-phenyl)-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(3-chloranyl-4-methyl-phenyl)-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide Openeye Name: 2-chloro-N-(3-chloro-4-methyl-phenyl)-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide CAS Name: 2-chloro-N-(3-chloro-4-methylphenyl)-5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-(3-chloro-4-methylphenyl)-5-(4-ethylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: 2-chloro-N-(3-chloro-4-methyl-phenyl)-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C20H24Cl2N3O3S+ MolecularWeight: 457.39386

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H23Cl2N3O3S/c1-3-24-8-10-25(11-9-24)29(27,28)16-6-7-18(21)17(13-16)20(26)23-15-5-4-14(2)19(22)12-15/h4-7,12-13H,3,8-11H2,1-2H3,(H,23,26)/p+1