3-cyano-N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]benzamide

Systemtic Name: 3-cyano-N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]benzamide Openeye Name: 3-cyano-N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]benzamide CAS Name: 3-cyano-N-[2-(4-dimethylaminophenyl)-2-(4-phenyl-1-piperazinyl)ethyl]benzamide IUPAC Name: 3-cyano-N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]benzamide Traditional Name: 3-cyano-N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazino)ethyl]benzamide Formula: C28H31N5O MolecularWeight: 453.57864

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=CC=CC(=C2)C#N)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=CC=CC(=C2)C#N)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C28H31N5O/c1-31(2)25-13-11-23(12-14-25)27(21-30-28(34)24-8-6-7-22(19-24)20-29)33-17-15-32(16-18-33)26-9-4-3-5-10-26/h3-14,19,27H,15-18,21H2,1-2H3,(H,30,34)