1-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]pyrrolidine-3-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-1-(4-bromo-3-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(4-bromo-3-methylphenyl)-5-oxo-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-1-(4-bromo-3-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-1-(4-bromo-3-methyl-phenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)NCC(=O)NCC3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)NCC(=O)NCC3=CC=CC=C3)Br

InChI

InChI=1S/C21H22BrN3O3/c1-14-9-17(7-8-18(14)22)25-13-16(10-20(25)27)21(28)24-12-19(26)23-11-15-5-3-2-4-6-15/h2-9,16H,10-13H2,1H3,(H,23,26)(H,24,28)