3-cyano-N-[[3-[3-[[(3R)-3-methylpiperazin-1-yl]methyl]phenyl]phenyl]methyl]benzamide

Systemtic Name: 3-cyano-N-[[3-[3-[[(3R)-3-methylpiperazin-1-yl]methyl]phenyl]phenyl]methyl]benzamide Openeye Name: 3-cyano-N-[[3-[3-[[(3R)-3-methylpiperazin-1-yl]methyl]phenyl]phenyl]methyl]benzamide CAS Name: 3-cyano-N-[[3-[3-[[(3R)-3-methyl-1-piperazinyl]methyl]phenyl]phenyl]methyl]benzamide IUPAC Name: 3-cyano-N-[[3-[3-[[(3R)-3-methylpiperazin-1-yl]methyl]phenyl]phenyl]methyl]benzamide Traditional Name: 3-cyano-N-[3-[3-[[(3R)-3-methylpiperazino]methyl]phenyl]benzyl]benzamide Formula: C27H28N4O MolecularWeight: 424.53742

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C[C@@H]1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H28N4O/c1-20-18-31(12-11-29-20)19-23-7-4-9-25(15-23)24-8-3-6-22(14-24)17-30-27(32)26-10-2-5-21(13-26)16-28/h2-10,13-15,20,29H,11-12,17-19H2,1H3,(H,30,32)/t20-/m1/s1