N-(3,5-dimethylphenyl)-N-[(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-1-oxidanylidene-propan-2-yl]methanesulfonamide

Systemtic Name: N-(3,5-dimethylphenyl)-N-[(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-1-oxidanylidene-propan-2-yl]methanesulfonamide Openeye Name: N-(3,5-dimethylphenyl)-N-[(1S)-2-(4-ethylpiperazin-4-ium-1-yl)-1-methyl-2-oxo-ethyl]methanesulfonamide CAS Name: N-(3,5-dimethylphenyl)-N-[(2S)-1-(4-ethyl-1-piperazin-4-iumyl)-1-oxopropan-2-yl]methanesulfonamide IUPAC Name: N-(3,5-dimethylphenyl)-N-[(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-1-oxopropan-2-yl]methanesulfonamide Traditional Name: N-(3,5-dimethylphenyl)-N-[(1S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-1-methyl-ethyl]methanesulfonamide Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)[C@H](C)N(C2=CC(=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C18H29N3O3S/c1-6-19-7-9-20(10-8-19)18(22)16(4)21(25(5,23)24)17-12-14(2)11-15(3)13-17/h11-13,16H,6-10H2,1-5H3/p+1/t16-/m0/s1