(3S)-N-[4-[(3-bromophenyl)carbamoyl]phenyl]-1-butyl-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-[4-[(3-bromophenyl)carbamoyl]phenyl]-1-butyl-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-[4-[(3-bromophenyl)carbamoyl]phenyl]-1-butyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-[4-[(3-bromoanilino)-oxomethyl]phenyl]-1-butyl-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-[4-[(3-bromophenyl)carbamoyl]phenyl]-1-butyl-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-[4-[(3-bromophenyl)carbamoyl]phenyl]-1-butyl-5-keto-pyrrolidine-3-carboxamide Formula: C22H24BrN3O3 MolecularWeight: 458.34826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CCCCN1C[C@H](CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H24BrN3O3/c1-2-3-11-26-14-16(12-20(26)27)22(29)24-18-9-7-15(8-10-18)21(28)25-19-6-4-5-17(23)13-19/h4-10,13,16H,2-3,11-12,14H2,1H3,(H,24,29)(H,25,28)/t16-/m0/s1