3-[methyl(pyridin-1-ium-2-yl)amino]propanethioamide

Systemtic Name: 3-[methyl(pyridin-1-ium-2-yl)amino]propanethioamide Openeye Name: 3-[methyl(pyridin-1-ium-2-yl)amino]propanethioamide CAS Name: 3-[methyl(2-pyridin-1-iumyl)amino]propanethioamide IUPAC Name: 3-[methyl(pyridin-1-ium-2-yl)amino]propanethioamide Traditional Name: 3-[methyl(pyridin-1-ium-2-yl)amino]thiopropionamide Formula: C9H14N3S+ MolecularWeight: 196.29256

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)C1=CC=CC=[NH+]1

Isomeric SMILES

CN(CCC(=S)N)C1=CC=CC=[NH+]1

InChI

InChI=1S/C9H13N3S/c1-12(7-5-8(10)13)9-4-2-3-6-11-9/h2-4,6H,5,7H2,1H3,(H2,10,13)/p+1