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

Systemtic Name: 1-(pyridin-3-ylmethyl)-3-[4-[[4-(pyridin-3-ylmethylcarbamoylamino)phenyl]methyl]phenyl]urea Openeye Name: 1-(3-pyridylmethyl)-3-[4-[[4-(3-pyridylmethylcarbamoylamino)phenyl]methyl]phenyl]urea CAS Name: 1-[4-[[4-[[oxo-(3-pyridinylmethylamino)methyl]amino]phenyl]methyl]phenyl]-3-(3-pyridinylmethyl)urea IUPAC Name: 1-(pyridin-3-ylmethyl)-3-[4-[[4-(pyridin-3-ylmethylcarbamoylamino)phenyl]methyl]phenyl]urea Traditional Name: 1-(3-pyridylmethyl)-3-[4-[4-(3-pyridylmethylcarbamoylamino)benzyl]phenyl]urea Formula: C27H26N6O2 MolecularWeight: 466.53434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C27H26N6O2/c34-26(30-18-22-3-1-13-28-16-22)32-24-9-5-20(6-10-24)15-21-7-11-25(12-8-21)33-27(35)31-19-23-4-2-14-29-17-23/h1-14,16-17H,15,18-19H2,(H2,30,32,34)(H2,31,33,35)