1-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-N-[1-[4-(propanoylamino)phenyl]ethyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-N-[1-[4-(propanoylamino)phenyl]ethyl]pyrrolidine-3-carboxamide Openeye Name: 1-(4-bromo-3-methyl-phenyl)-5-oxo-N-[1-[4-(propanoylamino)phenyl]ethyl]pyrrolidine-3-carboxamide CAS Name: 1-(4-bromo-3-methylphenyl)-5-oxo-N-[1-[4-(1-oxopropylamino)phenyl]ethyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-bromo-3-methylphenyl)-5-oxo-N-[1-[4-(propanoylamino)phenyl]ethyl]pyrrolidine-3-carboxamide Traditional Name: 1-(4-bromo-3-methyl-phenyl)-5-keto-N-[1-(4-propionamidophenyl)ethyl]pyrrolidine-3-carboxamide Formula: C23H26BrN3O3 MolecularWeight: 472.37484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)Br)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)Br)C

InChI

InChI=1S/C23H26BrN3O3/c1-4-21(28)26-18-7-5-16(6-8-18)15(3)25-23(30)17-12-22(29)27(13-17)19-9-10-20(24)14(2)11-19/h5-11,15,17H,4,12-13H2,1-3H3,(H,25,30)(H,26,28)