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

Systemtic Name: 2-[4-(6-bromanylpyridin-2-yl)carbonyl-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)ethanamide Openeye Name: 2-[4-(6-bromopyridine-2-carbonyl)-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)acetamide CAS Name: 2-[4-[(6-bromo-2-pyridinyl)-oxomethyl]-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)acetamide IUPAC Name: 2-[4-(6-bromopyridine-2-carbonyl)-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)acetamide Traditional Name: 2-[4-(6-bromopicolinoyl)-1,4-diazepan-1-yl]-N-(2,6-diethylphenyl)acetamide Formula: C23H29BrN4O2 MolecularWeight: 473.40596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)C(=O)C3=NC(=CC=C3)Br

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)C(=O)C3=NC(=CC=C3)Br

InChI

InChI=1S/C23H29BrN4O2/c1-3-17-8-5-9-18(4-2)22(17)26-21(29)16-27-12-7-13-28(15-14-27)23(30)19-10-6-11-20(24)25-19/h5-6,8-11H,3-4,7,12-16H2,1-2H3,(H,26,29)