Vitas-M small molecule compound

(5-amino-2-tert-butyl-4-cyanofuran-3(2H)-ylidene)propanedinitrile

Catalog ID
STL434832
SMILES N#CC(=C1C(=C(OC1C(C)(C)C)N)C#N)C#N

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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 C12H12N4O MW 228.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O/c1-12(2,3)10-9(7(4-13)5-14)8(6-15)11(16)17-10/h10H,16H2,1-3H3
InChIKey
XNGCOXDAXBSYHS-UHFFFAOYSA-N
Synonyms

(5amino2tertbutyl4cyanofuran3(2H)ylidene)propanedinitrile
2(5amino2tertbutyl4cyanofuran3ylidene)propanedinitrile
CC(C)(C)C1C(=C(C#N)C#N)C(=C(O1)N)C#N
InChI=1SC12H12N4Oc112(23)109(7(413)514)8(615)11(16)1710h10H16H213H3
MFCD30711449
ZINC000100257998
ZINC000100258000

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Available files

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