N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-methyl-2-[4-(thiophen-2-ylsulfonylamino)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-methyl-2-[4-(thiophen-2-ylsulfonylamino)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-N-methyl-2-[4-(2-thienylsulfonylamino)piperidin-1-ium-1-yl]acetamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-[4-(thiophen-2-ylsulfonylamino)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-[4-(thiophen-2-ylsulfonylamino)piperidin-1-ium-1-yl]acetamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-N-methyl-2-[4-(2-thienylsulfonylamino)piperidin-1-ium-1-yl]acetamide Formula: C18H31N4O4S2+ MolecularWeight: 431.59314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C[NH+]1CCC(CC1)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C[NH+]1CCC(CC1)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C18H30N4O4S2/c1-18(2,3)19-15(23)12-21(4)16(24)13-22-9-7-14(8-10-22)20-28(25,26)17-6-5-11-27-17/h5-6,11,14,20H,7-10,12-13H2,1-4H3,(H,19,23)/p+1