4-[(4-cyanophenyl)-[4-[(4-dimethylaminophenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[(4-cyanophenyl)-[4-[(4-dimethylaminophenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[(4-cyanophenyl)-[4-[(4-dimethylaminophenyl)methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[(4-cyanophenyl)-[4-[(4-dimethylaminophenyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[(4-cyanophenyl)-[4-[(4-dimethylaminophenyl)methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[(4-cyanophenyl)-[4-[4-(dimethylamino)benzyl]piperazino]methyl]benzonitrile Formula: C28H29N5 MolecularWeight: 435.56336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN2CCN(CC2)C(C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN2CCN(CC2)C(C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H29N5/c1-31(2)27-13-7-24(8-14-27)21-32-15-17-33(18-16-32)28(25-9-3-22(19-29)4-10-25)26-11-5-23(20-30)6-12-26/h3-14,28H,15-18,21H2,1-2H3