1-(2-bromophenyl)-N-[4-(2-methylpropanoylamino)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-[4-(2-methylpropanoylamino)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(2-bromophenyl)-N-[4-(2-methylpropanoylamino)phenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(2-bromophenyl)-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-[4-(2-methylpropanoylamino)phenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(2-bromophenyl)-N-[4-(isobutyrylamino)phenyl]-5-keto-pyrrolidine-3-carboxamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC=CC=C3Br

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC=CC=C3Br

InChI

InChI=1S/C21H22BrN3O3/c1-13(2)20(27)23-15-7-9-16(10-8-15)24-21(28)14-11-19(26)25(12-14)18-6-4-3-5-17(18)22/h3-10,13-14H,11-12H2,1-2H3,(H,23,27)(H,24,28)