ethyl 2,4-dimethyl-5-[[(phenylmethyl)-thiophen-2-ylcarbonyl-amino]methyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[[(phenylmethyl)-thiophen-2-ylcarbonyl-amino]methyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[[benzyl(thiophene-2-carbonyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[[oxo(thiophen-2-yl)methyl]-(phenylmethyl)amino]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[benzyl(thiophene-2-carbonyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[benzyl(2-thenoyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)CN(CC2=CC=CC=C2)C(=O)C3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)CN(CC2=CC=CC=C2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C22H24N2O3S/c1-4-27-22(26)20-15(2)18(23-16(20)3)14-24(13-17-9-6-5-7-10-17)21(25)19-11-8-12-28-19/h5-12,23H,4,13-14H2,1-3H3