Vitas-M small molecule compound

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

Catalog ID
STK997537
SMILES O=NN1N=C(C2C1C(=O)N(C2=O)c1cccc(c1)C)C(=O)OC

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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/c1-7-4-3-5-8(6-7)17-12(19)9-10(14(21)23-2)15-18(16-22)11(9)13(17)20/h3-6,9,11H,1-2H3
InChIKey
UZPWBSVAGQUZSZ-UHFFFAOYSA-N
Synonyms
1008073-71-9
1008073719
CC1=CC(=CC=C1)N2C(=O)C3C(C2=O)N(N=C3C(=O)OC)N=O
InChI=1SC14H12N4O5c174358(67)1712(19)910(14(21)232)1518(1622)11(9)13(17)20h36911H12H3
methyl1nitroso46dioxo5(mtolyl)13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
methyl5(3methylphenyl)1nitroso46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(3METHYLPHENYL)1NITROSO46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD03693341
ZINC000005069242
ZINC000101019900

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Available files

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