Vitas-M small molecule compound

3-amino-1-oxo-4,7-dihydro-1H-4,7-methanoisoindole-3a,7a-dicarbonitrile

Catalog ID
STK776336
SMILES N#CC12C3C=CC(C2(C#N)C(=NC1=O)N)C3

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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 C11H8N4O MW 212.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H8N4O/c12-4-10-6-1-2-7(3-6)11(10,5-13)9(16)15-8(10)14/h1-2,6-7H,3H2,(H2,14,15,16)
InChIKey
BIRPYSRSUMTTBO-UHFFFAOYSA-N
Synonyms

3amino1oxo47dihydro1H47methanoisoindole3a7adicarbonitrile
C1C2C=CC1C3(C2(C(=NC3=O)N)C#N)C#N
InChI=1SC11H8N4Oc124106127(36)11(10513)9(16)158(10)14h1267H3H2(H2141516)
MFCD05258877
ZINC000100161835
ZINC000245254629

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.