3-[methyl(pyridin-1-ium-4-yl)amino]propanethioamide

Systemtic Name: 3-[methyl(pyridin-1-ium-4-yl)amino]propanethioamide Openeye Name: 3-[methyl(pyridin-1-ium-4-yl)amino]propanethioamide CAS Name: 3-[methyl(4-pyridin-1-iumyl)amino]propanethioamide IUPAC Name: 3-[methyl(pyridin-1-ium-4-yl)amino]propanethioamide Traditional Name: 3-[methyl(pyridin-1-ium-4-yl)amino]thiopropionamide Formula: C9H14N3S+ MolecularWeight: 196.29256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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