2-[(4-methylphenyl)methylsulfanyl]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(p-tolylmethylsulfanyl)acetamide CAS Name: 2-[(4-methylphenyl)methylthio]-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-[(4-methylbenzyl)thio]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C17H27N2O2S+ MolecularWeight: 323.47348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C17H26N2O2S/c1-15-3-5-16(6-4-15)13-22-14-17(20)18-7-2-8-19-9-11-21-12-10-19/h3-6H,2,7-14H2,1H3,(H,18,20)/p+1