methyl 2,4-dimethyl-5-[2-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[2-(thiazol-4-ylmethylsulfanyl)benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[oxo-[2-(4-thiazolylmethylthio)phenyl]methoxy]propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-[2-(1,3-thiazol-4-ylmethylsulfanyl)benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[2-(thiazol-4-ylmethylthio)benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H22N2O5S2 MolecularWeight: 458.55048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=CC=CC=C2SCC3=CSC=N3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=CC=CC=C2SCC3=CSC=N3

InChI

InChI=1S/C22H22N2O5S2/c1-12-18(22(27)28-4)13(2)24-19(12)20(25)14(3)29-21(26)16-7-5-6-8-17(16)31-10-15-9-30-11-23-15/h5-9,11,14,24H,10H2,1-4H3