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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NCC2=CC=CS2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NCC2=CC=CS2)C

InChI

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