Vitas-M small molecule compound

methyl 5-(3,4-dichlorophenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Catalog ID
STL001411
SMILES COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(c(c1)Cl)Cl)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 C13H8Cl2N4O5 MW 371.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8Cl2N4O5/c1-24-13(22)9-8-10(19(16-9)17-23)12(21)18(11(8)20)5-2-3-6(14)7(15)4-5/h2-4,8,10H,1H3
InChIKey
MNHNNZZJJRVKLE-UHFFFAOYSA-N
Synonyms
1008230-84-9
1008230849
COC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC(=C(C=C3)Cl)Cl)N=O
InChI=1SC13H8Cl2N4O5c12413(22)9810(19(169)1723)12(21)18(11(8)20)5236(14)7(15)45h24810H1H3
methyl5(34dichlorophenyl)1nitroso46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(34DICHLOROPHENYL)1NITROSO46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD03695225
ZINC000005091427
ZINC000101023622

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Available files

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