ethyl 3-methyl-3-propyl-2-sulfanylidene-1H-imidazol-3-ium-4-carboxylate

Systemtic Name: ethyl 3-methyl-3-propyl-2-sulfanylidene-1H-imidazol-3-ium-4-carboxylate Openeye Name: ethyl 3-methyl-3-propyl-2-thioxo-1H-imidazol-3-ium-4-carboxylate CAS Name: 3-methyl-3-propyl-2-sulfanylidene-1H-imidazol-3-ium-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-3-propyl-2-sulfanylidene-1H-imidazol-3-ium-4-carboxylate Traditional Name: 3-methyl-3-propyl-2-thioxo-4-imidazolin-3-ium-4-carboxylic acid ethyl ester Formula: C10H17N2O2S+ MolecularWeight: 229.31918

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(C(=CNC1=S)C(=O)OCC)C

Isomeric SMILES

CCC[N+]1(C(=CNC1=S)C(=O)OCC)C

InChI

InChI=1S/C10H16N2O2S/c1-4-6-12(3)8(7-11-10(12)15)9(13)14-5-2/h7H,4-6H2,1-3H3/p+1