ethyl 4-ethyl-2-[[(4-methoxyphenyl)amino]methyl]-5-[(2-phenyl-1,3-thiazol-5-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-ethyl-2-[[(4-methoxyphenyl)amino]methyl]-5-[(2-phenyl-1,3-thiazol-5-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-ethyl-2-[(4-methoxyanilino)methyl]-5-[(2-phenylthiazol-5-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 4-ethyl-2-[(4-methoxyanilino)methyl]-5-[oxo-[(2-phenyl-5-thiazolyl)methylamino]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-[(4-methoxyanilino)methyl]-5-[(2-phenyl-1,3-thiazol-5-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-ethyl-2-(p-anisidinomethyl)-5-[(2-phenylthiazol-5-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C28H30N4O4S MolecularWeight: 518.6272

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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=CN=C(S3)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OCC)CNC2=CC=C(C=C2)OC)C(=O)NCC3=CN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C28H30N4O4S/c1-4-22-24(28(34)36-5-2)23(17-29-19-11-13-20(35-3)14-12-19)32-25(22)26(33)30-15-21-16-31-27(37-21)18-9-7-6-8-10-18/h6-14,16,29,32H,4-5,15,17H2,1-3H3,(H,30,33)