methyl 2,4-dimethyl-5-[2-[2-(2-methylphenyl)sulfanylethanoyloxy]propanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[2-(2-methylphenyl)sulfanylethanoyloxy]propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[2-(o-tolylsulfanyl)acetyl]oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[2-[(2-methylphenyl)thio]-1-oxoethoxy]-1-oxopropyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-[2-(2-methylphenyl)sulfanylacetyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[2-(o-tolylthio)acetyl]oxypropanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)C2=C(C(=C(N2)C)C(=O)OC)C

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)C2=C(C(=C(N2)C)C(=O)OC)C

InChI

InChI=1S/C20H23NO5S/c1-11-8-6-7-9-15(11)27-10-16(22)26-14(4)19(23)18-12(2)17(13(3)21-18)20(24)25-5/h6-9,14,21H,10H2,1-5H3