ethyl 2-methyl-4-(4-methylphenyl)-5-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-(4-methylphenyl)-5-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-5-[2-oxo-2-(2-thienylmethylamino)acetyl]-4-(p-tolyl)-1H-pyrrole-3-carboxylate CAS Name: 5-[1,2-dioxo-2-(thiophen-2-ylmethylamino)ethyl]-2-methyl-4-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-(4-methylphenyl)-5-[2-oxo-2-(thiophen-2-ylmethylamino)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-keto-2-(2-thenylamino)acetyl]-2-methyl-4-(p-tolyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)C)C(=O)C(=O)NCC3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)C)C(=O)C(=O)NCC3=CC=CS3)C

InChI

InChI=1S/C22H22N2O4S/c1-4-28-22(27)17-14(3)24-19(18(17)15-9-7-13(2)8-10-15)20(25)21(26)23-12-16-6-5-11-29-16/h5-11,24H,4,12H2,1-3H3,(H,23,26)