3-(2,4-dichlorophenyl)-N-ethyl-3-oxidanylidene-2-pyridin-1-ium-1-yl-propanethioamide

Systemtic Name: 3-(2,4-dichlorophenyl)-N-ethyl-3-oxidanylidene-2-pyridin-1-ium-1-yl-propanethioamide Openeye Name: 3-(2,4-dichlorophenyl)-N-ethyl-3-oxo-2-pyridin-1-ium-1-yl-propanethioamide CAS Name: 3-(2,4-dichlorophenyl)-N-ethyl-3-oxo-2-(1-pyridin-1-iumyl)propanethioamide IUPAC Name: 3-(2,4-dichlorophenyl)-N-ethyl-3-oxo-2-pyridin-1-ium-1-ylpropanethioamide Traditional Name: 3-(2,4-dichlorophenyl)-N-ethyl-3-keto-2-pyridin-1-ium-1-yl-thiopropionamide Formula: C16H15Cl2N2OS+ MolecularWeight: 354.2741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14Cl2N2OS/c1-2-19-16(22)14(20-8-4-3-5-9-20)15(21)12-7-6-11(17)10-13(12)18/h3-10,14H,2H2,1H3/p+1