4-[(5-bromanyl-2-phenylmethoxy-phenyl)methylamino]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-[(5-bromanyl-2-phenylmethoxy-phenyl)methylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-[(2-benzyloxy-5-bromo-phenyl)methylamino]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[(5-bromo-2-phenylmethoxyphenyl)methylamino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-[(5-bromo-2-phenylmethoxyphenyl)methylamino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-[(2-benzoxy-5-bromo-benzyl)amino]-N-(3-pyridylmethyl)benzamide Formula: C27H24BrN3O2 MolecularWeight: 502.40236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)CNC3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)CNC3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C27H24BrN3O2/c28-24-10-13-26(33-19-20-5-2-1-3-6-20)23(15-24)18-30-25-11-8-22(9-12-25)27(32)31-17-21-7-4-14-29-16-21/h1-16,30H,17-19H2,(H,31,32)