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

Systemtic Name: methyl 2,4-dimethyl-5-[2-[3-(4-methylphenyl)sulfanylpropanoyloxy]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[3-(p-tolylsulfanyl)propanoyloxy]acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[3-[(4-methylphenyl)thio]-1-oxopropoxy]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-[3-(4-methylphenyl)sulfanylpropanoyloxy]acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[3-(p-tolylthio)propanoyloxy]acetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)OCC(=O)C2=C(C(=C(N2)C)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)OCC(=O)C2=C(C(=C(N2)C)C(=O)OC)C

InChI

InChI=1S/C20H23NO5S/c1-12-5-7-15(8-6-12)27-10-9-17(23)26-11-16(22)19-13(2)18(14(3)21-19)20(24)25-4/h5-8,21H,9-11H2,1-4H3