The Groebke–Blackburn–Bienaymé reaction in its maturity: innovation and improvements since its 21st birthday (2019–2023)

Cristina Martini, Muhammad Idham Darussalam Mardjan and Andrea Basso
Beilstein J. Org. Chem. 2024, 20, 1839–1879. https://doi.org/10.3762/bjoc.20.162

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula C3H4N2S
Molecular Weight 100.14 g/mol
Exact Mass 100.0095 Da
InChI
InChI=1S/C3H4N2S/c4-3-5-1-2-6-3/h1-2H,(H2,4,5)
InChIKey
RAIPHJJURHTUIC-UHFFFAOYSA-N
SMILES
C1=CSC(=N1)N
Number of Atoms 10
Number of H-Bond Acceptors 2
Number of H-Bond Donors 1
Atoms in the Largest π-System 5
XLogP -0.2
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