ethyl 2,4-dimethyl-5-[(2S)-2-(2-methylsulfanylphenyl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(2S)-2-(2-methylsulfanylphenyl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(2S)-2-(2-methylsulfanylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-2-[[2-(methylthio)phenyl]-oxomethoxy]-1-oxopropyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2S)-2-(2-methylsulfanylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2S)-2-[2-(methylthio)benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)OC(=O)C2=CC=CC=C2SC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@H](C)OC(=O)C2=CC=CC=C2SC)C

InChI

InChI=1S/C20H23NO5S/c1-6-25-20(24)16-11(2)17(21-12(16)3)18(22)13(4)26-19(23)14-9-7-8-10-15(14)27-5/h7-10,13,21H,6H2,1-5H3/t13-/m0/s1