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

Systemtic Name: 1-(2-bromophenyl)-5-oxidanylidene-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrrolidine-3-carboxamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-1-(2-bromophenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(2-bromophenyl)-5-oxo-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(2-bromophenyl)-5-oxo-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrrolidine-3-carboxamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-1-(2-bromophenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H21BrN4O3 MolecularWeight: 457.32044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN4O3/c1-2-11-23-21(29)25-16-9-7-15(8-10-16)24-20(28)14-12-19(27)26(13-14)18-6-4-3-5-17(18)22/h2-10,14H,1,11-13H2,(H,24,28)(H2,23,25,29)