2-butylsulfanyl-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide

Systemtic Name: 2-butylsulfanyl-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide Openeye Name: 2-butylsulfanyl-N-(3-hydroxypyridin-1-ium-2-yl)acetamide CAS Name: 2-(butylthio)-N-(3-hydroxy-2-pyridin-1-iumyl)acetamide IUPAC Name: 2-butylsulfanyl-N-(3-hydroxypyridin-1-ium-2-yl)acetamide Traditional Name: 2-(butylthio)-N-(3-hydroxypyridin-1-ium-2-yl)acetamide Formula: C11H17N2O2S+ MolecularWeight: 241.32988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC1=C(C=CC=[NH+]1)O

Isomeric SMILES

CCCCSCC(=O)NC1=C(C=CC=[NH+]1)O

InChI

InChI=1S/C11H16N2O2S/c1-2-3-7-16-8-10(15)13-11-9(14)5-4-6-12-11/h4-6,14H,2-3,7-8H2,1H3,(H,12,13,15)/p+1