ethyl 3-cyano-6-ethyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-4-carboxylate

Systemtic Name: ethyl 3-cyano-6-ethyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-4-carboxylate Openeye Name: ethyl 3-cyano-6-ethyl-2-thioxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-4-carboxylate CAS Name: 3-cyano-6-ethyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-6-ethyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-4-carboxylate Traditional Name: 3-cyano-6-ethyl-2-thioxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-4-carboxylic acid ethyl ester Formula: C14H18N3O2S+ MolecularWeight: 292.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC2=C(C1)C(=C(C(=S)N2)C#N)C(=O)OCC

Isomeric SMILES

CC[NH+]1CCC2=C(C1)C(=C(C(=S)N2)C#N)C(=O)OCC

InChI

InChI=1S/C14H17N3O2S/c1-3-17-6-5-11-10(8-17)12(14(18)19-4-2)9(7-15)13(20)16-11/h3-6,8H2,1-2H3,(H,16,20)/p+1