N-ethyl-3-oxidanylidene-2-pyridin-1-ium-1-yl-3-thiophen-2-yl-propanethioamide

Systemtic Name: N-ethyl-3-oxidanylidene-2-pyridin-1-ium-1-yl-3-thiophen-2-yl-propanethioamide Openeye Name: N-ethyl-3-oxo-2-pyridin-1-ium-1-yl-3-(2-thienyl)propanethioamide CAS Name: N-ethyl-3-oxo-2-(1-pyridin-1-iumyl)-3-thiophen-2-ylpropanethioamide IUPAC Name: N-ethyl-3-oxo-2-pyridin-1-ium-1-yl-3-thiophen-2-ylpropanethioamide Traditional Name: N-ethyl-3-keto-2-pyridin-1-ium-1-yl-3-(2-thienyl)thiopropionamide Formula: C14H15N2OS2+ MolecularWeight: 291.4117

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)C(C(=O)C1=CC=CS1)[N+]2=CC=CC=C2

Isomeric SMILES

CCNC(=S)C(C(=O)C1=CC=CS1)[N+]2=CC=CC=C2

InChI

InChI=1S/C14H14N2OS2/c1-2-15-14(18)12(16-8-4-3-5-9-16)13(17)11-7-6-10-19-11/h3-10,12H,2H2,1H3/p+1