4-(4-cyano-2-methyl-phenyl)-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-(4-cyano-2-methyl-phenyl)-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-(4-cyano-2-methyl-phenyl)-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]benzamide CAS Name: 4-(4-cyano-2-methylphenyl)-N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]benzamide IUPAC Name: 4-(4-cyano-2-methylphenyl)-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]benzamide Traditional Name: 4-(4-cyano-2-methyl-phenyl)-N-[4-methoxy-3-(4-methylpiperazino)phenyl]benzamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)N4CCN(CC4)C

Isomeric SMILES

CC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)N4CCN(CC4)C

InChI

InChI=1S/C27H28N4O2/c1-19-16-20(18-28)4-10-24(19)21-5-7-22(8-6-21)27(32)29-23-9-11-26(33-3)25(17-23)31-14-12-30(2)13-15-31/h4-11,16-17H,12-15H2,1-3H3,(H,29,32)