O4-methyl O2-[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-methyl O2-[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-methyl O2-[2-oxo-2-[1-(2-thienyl)ethylamino]ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-methyl ester O2-[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: 4-O-methyl 2-O-[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-keto-2-[1-(2-thienyl)ethylamino]ethyl] ester O4-methyl ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC(C)C2=CC=CS2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC(C)C2=CC=CS2

InChI

InChI=1S/C17H20N2O5S/c1-9-14(16(21)23-4)11(3)19-15(9)17(22)24-8-13(20)18-10(2)12-6-5-7-25-12/h5-7,10,19H,8H2,1-4H3,(H,18,20)