Vitas-M small molecule compound
ethyl 1-nitroso-4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL239405
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccccc1)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/c1-2-23-14(21)10-9-11(18(15-10)16-22)13(20)17(12(9)19)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3InChIKey
COJFVEBCHFRABB-UHFFFAOYSA-NSynonyms
850766-88-0850766880
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=CC=C3)N=O
ethyl1nitroso46dioxo5phenyl13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL1NITROSO46DIOXO5PHENYL3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC14H12N4O5c122314(21)10911(18(1510)1622)13(20)17(12(9)19)8643578h37911H2H21H3
MFCD03688322
ZINC000005055126
ZINC000101007904
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