[4-(thiophen-2-ylcarbonylamino)phenyl] 1-(2-bromophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 1-(2-bromophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 1-(2-bromophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2-bromophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 1-(2-bromophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(2-bromophenyl)-5-keto-pyrrolidine-3-carboxylic acid [4-(2-thenoylamino)phenyl] ester Formula: C22H17BrN2O4S MolecularWeight: 485.35038

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2Br)C(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1C(CN(C1=O)C2=CC=CC=C2Br)C(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H17BrN2O4S/c23-17-4-1-2-5-18(17)25-13-14(12-20(25)26)22(28)29-16-9-7-15(8-10-16)24-21(27)19-6-3-11-30-19/h1-11,14H,12-13H2,(H,24,27)