2-[3-[4-(2-bromanyl-4-fluoranyl-phenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyridine-3-carboxamide

Systemtic Name: 2-[3-[4-(2-bromanyl-4-fluoranyl-phenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyridine-3-carboxamide Openeye Name: 2-[3-[4-(2-bromo-4-fluoro-phenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyridine-3-carboxamide CAS Name: 2-[3-[4-(2-bromo-4-fluorophenyl)-1-piperazinyl]propylamino]-N,N-dimethyl-3-pyridinecarboxamide IUPAC Name: 2-[3-[4-(2-bromo-4-fluorophenyl)piperazin-1-yl]propylamino]-N,N-dimethylpyridine-3-carboxamide Traditional Name: 2-[3-[4-(2-bromo-4-fluoro-phenyl)piperazino]propylamino]-N,N-dimethyl-nicotinamide Formula: C21H27BrFN5O MolecularWeight: 464.374383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=C(N=CC=C1)NCCCN2CCN(CC2)C3=C(C=C(C=C3)F)Br

Isomeric SMILES

CN(C)C(=O)C1=C(N=CC=C1)NCCCN2CCN(CC2)C3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C21H27BrFN5O/c1-26(2)21(29)17-5-3-8-24-20(17)25-9-4-10-27-11-13-28(14-12-27)19-7-6-16(23)15-18(19)22/h3,5-8,15H,4,9-14H2,1-2H3,(H,24,25)