N-[3-[[3-azanylpropyl-(3-fluorophenyl)carbonyl-amino]methyl]-4-chloranyl-phenyl]-2-bromanyl-benzamide

Systemtic Name: N-[3-[[3-azanylpropyl-(3-fluorophenyl)carbonyl-amino]methyl]-4-chloranyl-phenyl]-2-bromanyl-benzamide Openeye Name: N-[3-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]-4-chloro-phenyl]-2-bromo-benzamide CAS Name: N-[3-[[3-aminopropyl-[(3-fluorophenyl)-oxomethyl]amino]methyl]-4-chlorophenyl]-2-bromobenzamide IUPAC Name: N-[3-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]-4-chlorophenyl]-2-bromobenzamide Traditional Name: N-[3-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]-4-chloro-phenyl]-2-bromo-benzamide Formula: C24H22BrClFN3O2 MolecularWeight: 518.805783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)CN(CCCN)C(=O)C3=CC(=CC=C3)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)CN(CCCN)C(=O)C3=CC(=CC=C3)F)Br

InChI

InChI=1S/C24H22BrClFN3O2/c25-21-8-2-1-7-20(21)23(31)29-19-9-10-22(26)17(14-19)15-30(12-4-11-28)24(32)16-5-3-6-18(27)13-16/h1-3,5-10,13-14H,4,11-12,15,28H2,(H,29,31)