ethyl 2-[2-(1-methylpyrrol-3-yl)-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-(1-methylpyrrol-3-yl)-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(1-methylpyrrol-3-yl)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(1-methyl-3-pyrrolyl)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(1-methylpyrrol-3-yl)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(1-methylpyrrol-3-yl)ethyl]thio]acetic acid ethyl ester Formula: C11H15NO3S MolecularWeight: 241.3067

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)C1=CN(C=C1)C

Isomeric SMILES

CCOC(=O)CSCC(=O)C1=CN(C=C1)C

InChI

InChI=1S/C11H15NO3S/c1-3-15-11(14)8-16-7-10(13)9-4-5-12(2)6-9/h4-6H,3,7-8H2,1-2H3