1-(3-bromophenyl)-5-oxidanylidene-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(3-bromophenyl)-5-oxidanylidene-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide Openeye Name: 1-(3-bromophenyl)-5-oxo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide CAS Name: 1-(3-bromophenyl)-5-oxo-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(3-bromophenyl)-5-oxo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide Traditional Name: 1-(3-bromophenyl)-5-keto-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide Formula: C22H21BrN4O2 MolecularWeight: 453.33174

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC(=CC=C2)Br)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1C(CN(C1=O)C2=CC(=CC=C2)Br)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C22H21BrN4O2/c23-18-3-1-4-20(14-18)26-15-17(13-21(26)28)22(29)24-11-9-16-5-7-19(8-6-16)27-12-2-10-25-27/h1-8,10,12,14,17H,9,11,13,15H2,(H,24,29)