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

Systemtic Name: methyl 2,4-dimethyl-5-[2-(3-phenylsulfanylpropanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(3-phenylsulfanylpropanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[1-oxo-3-(phenylthio)propoxy]propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(3-phenylsulfanylpropanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[3-(phenylthio)propanoyloxy]propanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CCSC2=CC=CC=C2

InChI

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