(E)-N,N'-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]but-2-enediamide

Systemtic Name: (E)-N,N'-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]but-2-enediamide Openeye Name: (E)-N,N'-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]but-2-enediamide CAS Name: (E)-N,N'-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-butenediamide IUPAC Name: (E)-N,N'-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]but-2-enediamide Traditional Name: (E)-N,N'-bis[3-(2-imidazolin-2-yl)phenyl]but-2-enediamide Formula: C22H22N6O2 MolecularWeight: 402.44908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)C2=CC(=CC=C2)NC(=O)C=CC(=O)NC3=CC=CC(=C3)C4=NCCN4

Isomeric SMILES

C1CN=C(N1)C2=CC(=CC=C2)NC(=O)/C=C/C(=O)NC3=CC=CC(=C3)C4=NCCN4

InChI

InChI=1S/C22H22N6O2/c29-19(27-17-5-1-3-15(13-17)21-23-9-10-24-21)7-8-20(30)28-18-6-2-4-16(14-18)22-25-11-12-26-22/h1-8,13-14H,9-12H2,(H,23,24)(H,25,26)(H,27,29)(H,28,30)/b8-7+