ethyl 2-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)C1=C(C(=C(N1)C)C(=O)C)C

Isomeric SMILES

CCOC(=O)CSCC(=O)C1=C(C(=C(N1)C)C(=O)C)C

InChI

InChI=1S/C14H19NO4S/c1-5-19-12(18)7-20-6-11(17)14-8(2)13(10(4)16)9(3)15-14/h15H,5-7H2,1-4H3