2-tert-butylsulfanyl-N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]ethanamide

Systemtic Name: 2-tert-butylsulfanyl-N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]ethanamide Openeye Name: 2-tert-butylsulfanyl-N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]acetamide CAS Name: 2-(tert-butylthio)-N-[[2-(dimethylamino)-3-pyridin-1-iumyl]methyl]acetamide IUPAC Name: 2-tert-butylsulfanyl-N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]acetamide Traditional Name: 2-(tert-butylthio)-N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]acetamide Formula: C14H24N3OS+ MolecularWeight: 282.42486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)NCC1=C([NH+]=CC=C1)N(C)C

Isomeric SMILES

CC(C)(C)SCC(=O)NCC1=C([NH+]=CC=C1)N(C)C

InChI

InChI=1S/C14H23N3OS/c1-14(2,3)19-10-12(18)16-9-11-7-6-8-15-13(11)17(4)5/h6-8H,9-10H2,1-5H3,(H,16,18)/p+1