Catalytic aza-Nazarov cyclization reactions to access α-methylene-γ-lactam heterocycles

Bilge Banu Yagci, Selin Ezgi Donmez, Onur Şahin and Yunus Emre Türkmen
Beilstein J. Org. Chem. 2023, 19, 66–77. https://doi.org/10.3762/bjoc.19.6

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula C16H23NOS
Molecular Weight 277.43 g/mol
Exact Mass 277.1500 Da
InChI
InChI=1S/C16H23NOS/c1-5-8-17-15(14-7-6-9-19-14)13(10-11(2)3)12(4)16(17)18/h6-7,9,11,13,15H,4-5,8,10H2,1-3H3/t13-,15-/m0/s1
InChIKey
SYLXDYRSWXRBOW-ZFWWWQNUSA-N
SMILES
CCCN1[C@@H]([C@@H](CC(C)C)C(=C)C1=O)C2=CC=CS2
Number of Atoms 42
Number of H-Bond Acceptors 2
Number of H-Bond Donors 0
Atoms in the Largest π-System 5
XLogP 3.5
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