ethyl 2-[5-(2-ethoxy-1-methylsulfanyl-2-oxidanylidene-ethyl)-1H-pyrrol-2-yl]-2-methylsulfanyl-ethanoate

Systemtic Name: ethyl 2-[5-(2-ethoxy-1-methylsulfanyl-2-oxidanylidene-ethyl)-1H-pyrrol-2-yl]-2-methylsulfanyl-ethanoate Openeye Name: ethyl 2-[5-(2-ethoxy-1-methylsulfanyl-2-oxo-ethyl)-1H-pyrrol-2-yl]-2-methylsulfanyl-acetate CAS Name: 2-[5-[2-ethoxy-1-(methylthio)-2-oxoethyl]-1H-pyrrol-2-yl]-2-(methylthio)acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(2-ethoxy-1-methylsulfanyl-2-oxoethyl)-1H-pyrrol-2-yl]-2-methylsulfanylacetate Traditional Name: 2-[5-[2-ethoxy-2-keto-1-(methylthio)ethyl]-1H-pyrrol-2-yl]-2-(methylthio)acetic acid ethyl ester Formula: C14H21NO4S2 MolecularWeight: 331.45084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(N1)C(C(=O)OCC)SC)SC

Isomeric SMILES

CCOC(=O)C(C1=CC=C(N1)C(C(=O)OCC)SC)SC

InChI

InChI=1S/C14H21NO4S2/c1-5-18-13(16)11(20-3)9-7-8-10(15-9)12(21-4)14(17)19-6-2/h7-8,11-12,15H,5-6H2,1-4H3