ethyl 4-ethyl-5-[(4-fluorophenyl)methylcarbamoyl]-2-[[(4-methoxyphenyl)amino]methyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-[(4-fluorophenyl)methylcarbamoyl]-2-[[(4-methoxyphenyl)amino]methyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-ethyl-5-[(4-fluorophenyl)methylcarbamoyl]-2-[(4-methoxyanilino)methyl]-1H-pyrrole-3-carboxylate CAS Name: 4-ethyl-5-[[(4-fluorophenyl)methylamino]-oxomethyl]-2-[(4-methoxyanilino)methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-[(4-fluorophenyl)methylcarbamoyl]-2-[(4-methoxyanilino)methyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-ethyl-5-[(4-fluorobenzyl)carbamoyl]-2-(p-anisidinomethyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C25H28FN3O4 MolecularWeight: 453.505923

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)OCC)CNC2=CC=C(C=C2)OC)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OCC)CNC2=CC=C(C=C2)OC)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C25H28FN3O4/c1-4-20-22(25(31)33-5-2)21(15-27-18-10-12-19(32-3)13-11-18)29-23(20)24(30)28-14-16-6-8-17(26)9-7-16/h6-13,27,29H,4-5,14-15H2,1-3H3,(H,28,30)