3,5-bis[[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]carbamoylamino]-N-methyl-benzamide

Systemtic Name: 3,5-bis[[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]carbamoylamino]-N-methyl-benzamide Openeye Name: 3,5-bis[[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]carbamoylamino]-N-methyl-benzamide CAS Name: 3,5-bis[[[3-(4,5-dihydro-1H-imidazol-2-yl)anilino]-oxomethyl]amino]-N-methylbenzamide IUPAC Name: 3,5-bis[[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]carbamoylamino]-N-methylbenzamide Traditional Name: 3,5-bis[[3-(2-imidazolin-2-yl)phenyl]carbamoylamino]-N-methyl-benzamide Formula: C28H29N9O3 MolecularWeight: 539.58836

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC(=C1)NC(=O)NC2=CC=CC(=C2)C3=NCCN3)NC(=O)NC4=CC=CC(=C4)C5=NCCN5

Isomeric SMILES

CNC(=O)C1=CC(=CC(=C1)NC(=O)NC2=CC=CC(=C2)C3=NCCN3)NC(=O)NC4=CC=CC(=C4)C5=NCCN5

InChI

InChI=1S/C28H29N9O3/c1-29-26(38)19-14-22(36-27(39)34-20-6-2-4-17(12-20)24-30-8-9-31-24)16-23(15-19)37-28(40)35-21-7-3-5-18(13-21)25-32-10-11-33-25/h2-7,12-16H,8-11H2,1H3,(H,29,38)(H,30,31)(H,32,33)(H2,34,36,39)(H2,35,37,40)