1-(4-cyanophenyl)-3-[[2-(4-pyridin-4-ylpiperazin-1-yl)phenyl]methyl]urea

Systemtic Name: 1-(4-cyanophenyl)-3-[[2-(4-pyridin-4-ylpiperazin-1-yl)phenyl]methyl]urea Openeye Name: 1-(4-cyanophenyl)-3-[[2-[4-(4-pyridyl)piperazin-1-yl]phenyl]methyl]urea CAS Name: 1-(4-cyanophenyl)-3-[[2-(4-pyridin-4-yl-1-piperazinyl)phenyl]methyl]urea IUPAC Name: 1-(4-cyanophenyl)-3-[[2-(4-pyridin-4-ylpiperazin-1-yl)phenyl]methyl]urea Traditional Name: 1-(4-cyanophenyl)-3-[2-[4-(4-pyridyl)piperazino]benzyl]urea Formula: C24H24N6O MolecularWeight: 412.48696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C3=CC=CC=C3CNC(=O)NC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C3=CC=CC=C3CNC(=O)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H24N6O/c25-17-19-5-7-21(8-6-19)28-24(31)27-18-20-3-1-2-4-23(20)30-15-13-29(14-16-30)22-9-11-26-12-10-22/h1-12H,13-16,18H2,(H2,27,28,31)