Vitas-M small molecule compound

ethyl 5-benzyl-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Catalog ID
STL006996
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)Cc1ccccc1)N=O

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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 C15H14N4O5 MW 330.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O5/c1-2-24-15(22)11-10-12(19(16-11)17-23)14(21)18(13(10)20)8-9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3
InChIKey
PKEOVYGIQJOKOY-UHFFFAOYSA-N
Synonyms
1008950-33-1
1008950331
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)CC3=CC=CC=C3)N=O
ethyl5benzyl1nitroso46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5BENZYL1NITROSO46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC15H14N4O5c122415(22)111012(19(1611)1723)14(21)18(13(10)20)89643579h371012H28H21H3
MFCD03685505
ZINC000005053826
ZINC000101001172

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Available files

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