4-[1-azanyl-2-[2-(5-bromanylpyridin-3-yl)ethanoyl-methyl-amino]ethyl]-N-pyridin-4-yl-benzamide

Systemtic Name: 4-[1-azanyl-2-[2-(5-bromanylpyridin-3-yl)ethanoyl-methyl-amino]ethyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-2-[[2-(5-bromo-3-pyridyl)acetyl]-methyl-amino]ethyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-2-[[2-(5-bromo-3-pyridinyl)-1-oxoethyl]-methylamino]ethyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-2-[[2-(5-bromopyridin-3-yl)acetyl]-methylamino]ethyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-2-[[2-(5-bromo-3-pyridyl)acetyl]-methyl-amino]ethyl]-N-(4-pyridyl)benzamide Formula: C22H22BrN5O2 MolecularWeight: 468.34638

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N)C(=O)CC3=CC(=CN=C3)Br

Isomeric SMILES

CN(CC(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N)C(=O)CC3=CC(=CN=C3)Br

InChI

InChI=1S/C22H22BrN5O2/c1-28(21(29)11-15-10-18(23)13-26-12-15)14-20(24)16-2-4-17(5-3-16)22(30)27-19-6-8-25-9-7-19/h2-10,12-13,20H,11,14,24H2,1H3,(H,25,27,30)