2-[4-(6-bromanylpyridin-2-yl)carbonyl-1,4-diazepan-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(6-bromanylpyridin-2-yl)carbonyl-1,4-diazepan-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-(6-bromopyridine-2-carbonyl)-1,4-diazepan-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[(6-bromo-2-pyridinyl)-oxomethyl]-1,4-diazepan-1-yl]-N-phenylacetamide IUPAC Name: 2-[4-(6-bromopyridine-2-carbonyl)-1,4-diazepan-1-yl]-N-phenylacetamide Traditional Name: 2-[4-(6-bromopicolinoyl)-1,4-diazepan-1-yl]-N-phenyl-acetamide Formula: C19H21BrN4O2 MolecularWeight: 417.29964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=NC(=CC=C2)Br)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=NC(=CC=C2)Br)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C19H21BrN4O2/c20-17-9-4-8-16(22-17)19(26)24-11-5-10-23(12-13-24)14-18(25)21-15-6-2-1-3-7-15/h1-4,6-9H,5,10-14H2,(H,21,25)