1-(pyridin-3-ylmethyl)-3-[4-[2-[4-(pyridin-3-ylmethylcarbamoylamino)phenyl]ethyl]phenyl]urea

Systemtic Name: 1-(pyridin-3-ylmethyl)-3-[4-[2-[4-(pyridin-3-ylmethylcarbamoylamino)phenyl]ethyl]phenyl]urea Openeye Name: 1-(3-pyridylmethyl)-3-[4-[2-[4-(3-pyridylmethylcarbamoylamino)phenyl]ethyl]phenyl]urea CAS Name: 1-[4-[2-[4-[[oxo-(3-pyridinylmethylamino)methyl]amino]phenyl]ethyl]phenyl]-3-(3-pyridinylmethyl)urea IUPAC Name: 1-(pyridin-3-ylmethyl)-3-[4-[2-[4-(pyridin-3-ylmethylcarbamoylamino)phenyl]ethyl]phenyl]urea Traditional Name: 1-(3-pyridylmethyl)-3-[4-[2-[4-(3-pyridylmethylcarbamoylamino)phenyl]ethyl]phenyl]urea Formula: C28H28N6O2 MolecularWeight: 480.56092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)NC2=CC=C(C=C2)CCC3=CC=C(C=C3)NC(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)NC2=CC=C(C=C2)CCC3=CC=C(C=C3)NC(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C28H28N6O2/c35-27(31-19-23-3-1-15-29-17-23)33-25-11-7-21(8-12-25)5-6-22-9-13-26(14-10-22)34-28(36)32-20-24-4-2-16-30-18-24/h1-4,7-18H,5-6,19-20H2,(H2,31,33,35)(H2,32,34,36)