Vitas-M small molecule compound
3-bromo-1,8,8-trimethyl-6-oxo-2,7-diazabicyclo[3.2.1]oct-3-ene-4,5-dicarbonitrile
Catalog ID
STK693693
SMILES N#CC1=C(Br)NC2(C(C1(C#N)C(=O)N2)(C)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C11H11BrN4O MW 295.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11BrN4O/c1-9(2)10(3)15-7(12)6(4-13)11(9,5-14)8(17)16-10/h15H,1-3H3,(H,16,17)InChIKey
CGEWWTTYYKFYTQ-UHFFFAOYSA-NSynonyms
3bromo188trimethyl6oxo27diazabicyclo(321)oct3ene45dicarbonitrile
CC1(C2(NC(=C(C1(C(=O)N2)C#N)C#N)Br)C)C
InChI=1SC11H11BrN4Oc19(2)10(3)157(12)6(413)11(9514)8(17)1610h15H13H3(H1617)
MFCD12966013
ZINC000022173269
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