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

Systemtic Name: O2-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-isopropyl 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 O2-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester O4-propan-2-yl ester IUPAC Name: 2-O-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 4-O-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-isopropyl ester O2-[2-keto-2-(2-thenylamino)ethyl] ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC(=O)NCC2=CC=CS2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC(=O)NCC2=CC=CS2

InChI

InChI=1S/C18H22N2O5S/c1-10(2)25-17(22)15-11(3)16(20-12(15)4)18(23)24-9-14(21)19-8-13-6-5-7-26-13/h5-7,10,20H,8-9H2,1-4H3,(H,19,21)