2-[[2,5-bis(chloranyl)phenyl]sulfonyl-methyl-amino]-N-(4-methylpiperazin-4-ium-1-yl)ethanamide

Systemtic Name: 2-[[2,5-bis(chloranyl)phenyl]sulfonyl-methyl-amino]-N-(4-methylpiperazin-4-ium-1-yl)ethanamide Openeye Name: 2-[(2,5-dichlorophenyl)sulfonyl-methyl-amino]-N-(4-methylpiperazin-4-ium-1-yl)acetamide CAS Name: 2-[(2,5-dichlorophenyl)sulfonyl-methylamino]-N-(4-methyl-1-piperazin-4-iumyl)acetamide IUPAC Name: 2-[(2,5-dichlorophenyl)sulfonyl-methylamino]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Traditional Name: 2-[(2,5-dichlorophenyl)sulfonyl-methyl-amino]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Formula: C14H21Cl2N4O3S+ MolecularWeight: 396.31254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20Cl2N4O3S/c1-18-5-7-20(8-6-18)17-14(21)10-19(2)24(22,23)13-9-11(15)3-4-12(13)16/h3-4,9H,5-8,10H2,1-2H3,(H,17,21)/p+1