[2-(2-methoxyethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-(2-methoxyethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-(2-methoxyethylcarbamoylamino)-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-[[(2-methoxyethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylcarbamoylamino)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-keto-2-(2-methoxyethylcarbamoylamino)ethyl] ester Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)NC(=O)COC(=O)C1=C(N=CC=C1)SC

Isomeric SMILES

COCCNC(=O)NC(=O)COC(=O)C1=C(N=CC=C1)SC

InChI

InChI=1S/C13H17N3O5S/c1-20-7-6-15-13(19)16-10(17)8-21-12(18)9-4-3-5-14-11(9)22-2/h3-5H,6-8H2,1-2H3,(H2,15,16,17,19)