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

Systemtic Name: 1-(4-bromophenyl)-3-[[2-(4-pyridin-4-ylpiperazin-1-yl)phenyl]methyl]urea Openeye Name: 1-(4-bromophenyl)-3-[[2-[4-(4-pyridyl)piperazin-1-yl]phenyl]methyl]urea CAS Name: 1-(4-bromophenyl)-3-[[2-(4-pyridin-4-yl-1-piperazinyl)phenyl]methyl]urea IUPAC Name: 1-(4-bromophenyl)-3-[[2-(4-pyridin-4-ylpiperazin-1-yl)phenyl]methyl]urea Traditional Name: 1-(4-bromophenyl)-3-[2-[4-(4-pyridyl)piperazino]benzyl]urea Formula: C23H24BrN5O MolecularWeight: 466.37356

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C23H24BrN5O/c24-19-5-7-20(8-6-19)27-23(30)26-17-18-3-1-2-4-22(18)29-15-13-28(14-16-29)21-9-11-25-12-10-21/h1-12H,13-17H2,(H2,26,27,30)