3-cyano-N-[3-[4-methoxy-3-[(4-methylpiperazin-1-yl)methyl]phenyl]phenyl]benzamide

Systemtic Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methylpiperazin-1-yl)methyl]phenyl]phenyl]benzamide Openeye Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methylpiperazin-1-yl)methyl]phenyl]phenyl]benzamide CAS Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methyl-1-piperazinyl)methyl]phenyl]phenyl]benzamide IUPAC Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methylpiperazin-1-yl)methyl]phenyl]phenyl]benzamide Traditional Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methylpiperazino)methyl]phenyl]phenyl]benzamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C=CC(=C2)C3=CC(=CC=C3)NC(=O)C4=CC=CC(=C4)C#N)OC

Isomeric SMILES

CN1CCN(CC1)CC2=C(C=CC(=C2)C3=CC(=CC=C3)NC(=O)C4=CC=CC(=C4)C#N)OC

InChI

InChI=1S/C27H28N4O2/c1-30-11-13-31(14-12-30)19-24-16-22(9-10-26(24)33-2)21-6-4-8-25(17-21)29-27(32)23-7-3-5-20(15-23)18-28/h3-10,15-17H,11-14,19H2,1-2H3,(H,29,32)