N-(3-chlorophenyl)-N-[2-oxidanylidene-2-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethyl]methanesulfonamide

Systemtic Name: N-(3-chlorophenyl)-N-[2-oxidanylidene-2-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethyl]methanesulfonamide Openeye Name: N-(3-chlorophenyl)-N-[2-oxo-2-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]ethyl]methanesulfonamide CAS Name: N-(3-chlorophenyl)-N-[2-oxo-2-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]ethyl]methanesulfonamide IUPAC Name: N-(3-chlorophenyl)-N-[2-oxo-2-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethyl]methanesulfonamide Traditional Name: N-(3-chlorophenyl)-N-[2-keto-2-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]ethyl]methanesulfonamide Formula: C19H24ClN4O3S+ MolecularWeight: 423.93686

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)N1CC[NH+](CC1)CC2=CC=NC=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N(CC(=O)N1CC[NH+](CC1)CC2=CC=NC=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H23ClN4O3S/c1-28(26,27)24(18-4-2-3-17(20)13-18)15-19(25)23-11-9-22(10-12-23)14-16-5-7-21-8-6-16/h2-8,13H,9-12,14-15H2,1H3/p+1