N-propan-2-yl-2-[2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-propan-2-yl-2-[2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-isopropyl-2-[[2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: 2-[[1-oxo-2-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]amino]-N-propan-2-ylacetamide IUPAC Name: N-propan-2-yl-2-[[2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-isopropyl-2-[[2-(4-mesitylsulfonylpiperazin-1-ium-1-yl)acetyl]amino]acetamide Formula: C20H33N4O4S+ MolecularWeight: 425.56542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC(=O)NC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC(=O)NC(C)C)C

InChI

InChI=1S/C20H32N4O4S/c1-14(2)22-18(25)12-21-19(26)13-23-6-8-24(9-7-23)29(27,28)20-16(4)10-15(3)11-17(20)5/h10-11,14H,6-9,12-13H2,1-5H3,(H,21,26)(H,22,25)/p+1