N-[(2S)-butan-2-yl]-4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]benzenesulfonamide

Systemtic Name: N-[(2S)-butan-2-yl]-4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]benzenesulfonamide Openeye Name: 4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]-N-[(1S)-1-methylpropyl]benzenesulfonamide CAS Name: N-[(2S)-butan-2-yl]-4-[2-(4-ethyl-1-piperazin-4-iumyl)-2-oxoethoxy]benzenesulfonamide IUPAC Name: N-[(2S)-butan-2-yl]-4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxoethoxy]benzenesulfonamide Traditional Name: 4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-ethoxy]-N-[(1S)-1-methylpropyl]benzenesulfonamide Formula: C18H30N3O4S+ MolecularWeight: 384.5135

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)N2CC[NH+](CC2)CC

Isomeric SMILES

CC[C@H](C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)N2CC[NH+](CC2)CC

InChI

InChI=1S/C18H29N3O4S/c1-4-15(3)19-26(23,24)17-8-6-16(7-9-17)25-14-18(22)21-12-10-20(5-2)11-13-21/h6-9,15,19H,4-5,10-14H2,1-3H3/p+1/t15-/m0/s1