1-(pyridin-4-ylmethyl)-3-[[3-[(pyridin-4-ylmethylcarbamoylamino)methyl]phenyl]methyl]urea

Systemtic Name: 1-(pyridin-4-ylmethyl)-3-[[3-[(pyridin-4-ylmethylcarbamoylamino)methyl]phenyl]methyl]urea Openeye Name: 1-(4-pyridylmethyl)-3-[[3-[(4-pyridylmethylcarbamoylamino)methyl]phenyl]methyl]urea CAS Name: 1-[[3-[[[oxo-(pyridin-4-ylmethylamino)methyl]amino]methyl]phenyl]methyl]-3-(pyridin-4-ylmethyl)urea IUPAC Name: 1-(pyridin-4-ylmethyl)-3-[[3-[(pyridin-4-ylmethylcarbamoylamino)methyl]phenyl]methyl]urea Traditional Name: 1-(4-pyridylmethyl)-3-[3-[(4-pyridylmethylcarbamoylamino)methyl]benzyl]urea Formula: C22H24N6O2 MolecularWeight: 404.46496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC(=O)NCC2=CC=NC=C2)CNC(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)CNC(=O)NCC2=CC=NC=C2)CNC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C22H24N6O2/c29-21(25-13-17-4-8-23-9-5-17)27-15-19-2-1-3-20(12-19)16-28-22(30)26-14-18-6-10-24-11-7-18/h1-12H,13-16H2,(H2,25,27,29)(H2,26,28,30)