1-(2-bromophenyl)-5-oxidanylidene-N-[3-(2-pyrazol-1-ylethoxy)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(2-bromophenyl)-5-oxidanylidene-N-[3-(2-pyrazol-1-ylethoxy)phenyl]pyrrolidine-3-carboxamide Openeye Name: 1-(2-bromophenyl)-5-oxo-N-[3-(2-pyrazol-1-ylethoxy)phenyl]pyrrolidine-3-carboxamide CAS Name: 1-(2-bromophenyl)-5-oxo-N-[3-[2-(1-pyrazolyl)ethoxy]phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(2-bromophenyl)-5-oxo-N-[3-(2-pyrazol-1-ylethoxy)phenyl]pyrrolidine-3-carboxamide Traditional Name: 1-(2-bromophenyl)-5-keto-N-[3-(2-pyrazol-1-ylethoxy)phenyl]pyrrolidine-3-carboxamide Formula: C22H21BrN4O3 MolecularWeight: 469.33114

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2Br)C(=O)NC3=CC(=CC=C3)OCCN4C=CC=N4

Isomeric SMILES

C1C(CN(C1=O)C2=CC=CC=C2Br)C(=O)NC3=CC(=CC=C3)OCCN4C=CC=N4

InChI

InChI=1S/C22H21BrN4O3/c23-19-7-1-2-8-20(19)27-15-16(13-21(27)28)22(29)25-17-5-3-6-18(14-17)30-12-11-26-10-4-9-24-26/h1-10,14,16H,11-13,15H2,(H,25,29)