2-chloranyl-N-[(2,4-dichlorophenyl)methyl]-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-methyl-benzamide

Systemtic Name: 2-chloranyl-N-[(2,4-dichlorophenyl)methyl]-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-methyl-benzamide Openeye Name: 2-chloro-N-[(2,4-dichlorophenyl)methyl]-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-methyl-benzamide CAS Name: 2-chloro-N-[(2,4-dichlorophenyl)methyl]-5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]-N-methylbenzamide IUPAC Name: 2-chloro-N-[(2,4-dichlorophenyl)methyl]-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-methylbenzamide Traditional Name: 2-chloro-N-(2,4-dichlorobenzyl)-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-methyl-benzamide Formula: C21H25Cl3N3O3S+ MolecularWeight: 505.8655

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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)N(C)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N(C)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H24Cl3N3O3S/c1-3-26-8-10-27(11-9-26)31(29,30)17-6-7-19(23)18(13-17)21(28)25(2)14-15-4-5-16(22)12-20(15)24/h4-7,12-13H,3,8-11,14H2,1-2H3/p+1