3-[[bis(phenylmethyl)amino]methyl]-N-[[4-fluoranyl-3-[3-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]phenyl]methyl]benzamide

Systemtic Name: 3-[[bis(phenylmethyl)amino]methyl]-N-[[4-fluoranyl-3-[3-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]phenyl]methyl]benzamide Openeye Name: 3-[(dibenzylamino)methyl]-N-[[4-fluoro-3-[3-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]phenyl]methyl]benzamide CAS Name: 3-[[bis(phenylmethyl)amino]methyl]-N-[[4-fluoro-3-[3-[[(3S)-3-methyl-1-piperazinyl]methyl]phenyl]phenyl]methyl]benzamide IUPAC Name: 3-[(dibenzylamino)methyl]-N-[[4-fluoro-3-[3-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]phenyl]methyl]benzamide Traditional Name: 3-[(dibenzylamino)methyl]-N-[4-fluoro-3-[3-[[(3S)-3-methylpiperazino]methyl]phenyl]benzyl]benzamide Formula: C41H43FN4O MolecularWeight: 626.804723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CC=CC(=C2)C3=C(C=CC(=C3)CNC(=O)C4=CC(=CC=C4)CN(CC5=CC=CC=C5)CC6=CC=CC=C6)F

Isomeric SMILES

C[C@H]1CN(CCN1)CC2=CC=CC(=C2)C3=C(C=CC(=C3)CNC(=O)C4=CC(=CC=C4)CN(CC5=CC=CC=C5)CC6=CC=CC=C6)F

InChI

InChI=1S/C41H43FN4O/c1-31-26-45(21-20-43-31)29-35-14-8-16-37(22-35)39-24-34(18-19-40(39)42)25-44-41(47)38-17-9-15-36(23-38)30-46(27-32-10-4-2-5-11-32)28-33-12-6-3-7-13-33/h2-19,22-24,31,43H,20-21,25-30H2,1H3,(H,44,47)/t31-/m0/s1