N-(2-methylsulfanylphenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(2-methylsulfanylphenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(2-methylsulfanylphenyl)-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[2-(methylthio)phenyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(2-methylsulfanylphenyl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[2-(methylthio)phenyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C13H19N2OS+ MolecularWeight: 251.36776

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C[NH+]2CCCC2

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C[NH+]2CCCC2

InChI

InChI=1S/C13H18N2OS/c1-17-12-7-3-2-6-11(12)14-13(16)10-15-8-4-5-9-15/h2-3,6-7H,4-5,8-10H2,1H3,(H,14,16)/p+1