(phenylmethyl) 1-methyl-2-(4-methylphenyl)-4-thiophen-2-yl-pyrrole-3-carboxylate

Systemtic Name: (phenylmethyl) 1-methyl-2-(4-methylphenyl)-4-thiophen-2-yl-pyrrole-3-carboxylate Openeye Name: benzyl 1-methyl-2-(p-tolyl)-4-(2-thienyl)pyrrole-3-carboxylate CAS Name: 1-methyl-2-(4-methylphenyl)-4-thiophen-2-yl-3-pyrrolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-methyl-2-(4-methylphenyl)-4-thiophen-2-ylpyrrole-3-carboxylate Traditional Name: 1-methyl-2-(p-tolyl)-4-(2-thienyl)pyrrole-3-carboxylic acid benzyl ester Formula: C24H21NO2S MolecularWeight: 387.49404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=CN2C)C3=CC=CS3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=CN2C)C3=CC=CS3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C24H21NO2S/c1-17-10-12-19(13-11-17)23-22(20(15-25(23)2)21-9-6-14-28-21)24(26)27-16-18-7-4-3-5-8-18/h3-15H,16H2,1-2H3