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

Systemtic Name: 2-[4-(6-bromanylpyridin-2-yl)carbonyl-1,4-diazepan-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(6-bromopyridine-2-carbonyl)-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-[(6-bromo-2-pyridinyl)-oxomethyl]-1,4-diazepan-1-yl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(6-bromopyridine-2-carbonyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(6-bromopicolinoyl)-1,4-diazepan-1-yl]acetamide Formula: C20H23BrN4O2 MolecularWeight: 431.32622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=NC(=CC=C2)Br)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=NC(=CC=C2)Br)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H23BrN4O2/c21-18-9-4-8-17(23-18)20(27)25-11-5-10-24(12-13-25)15-19(26)22-14-16-6-2-1-3-7-16/h1-4,6-9H,5,10-15H2,(H,22,26)