Vitas-M small molecule compound
methyl 5-benzyl-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL239273
SMILES COC(=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 C14H12N4O5 MW 316.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O5/c1-23-14(21)10-9-11(18(15-10)16-22)13(20)17(12(9)19)7-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3InChIKey
NKXLTYSZOUSQJX-UHFFFAOYSA-NSynonyms
1008866-74-71008866747
COC(=O)C1=NN(C2C1C(=O)N(C2=O)CC3=CC=CC=C3)N=O
InChI=1SC14H12N4O5c12314(21)10911(18(1510)1622)13(20)17(12(9)19)78532468h26911H7H21H3
methyl5benzyl1nitroso46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5BENZYL1NITROSO46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD03694642
ZINC000005091012
ZINC000101022429
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