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

Systemtic Name: 1-(phenylmethyl)-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-benzyl-3-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]urea CAS Name: 1-(phenylmethyl)-3-[4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenyl]urea IUPAC Name: 1-benzyl-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-benzyl-3-[4-[[4-(2-pyridyl)piperazino]methyl]phenyl]urea Formula: C24H27N5O MolecularWeight: 401.50408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)NC(=O)NCC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)NC(=O)NCC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C24H27N5O/c30-24(26-18-20-6-2-1-3-7-20)27-22-11-9-21(10-12-22)19-28-14-16-29(17-15-28)23-8-4-5-13-25-23/h1-13H,14-19H2,(H2,26,27,30)