Vitas-M small molecule compound
ethyl 5-(3-chloro-4-methylphenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL001097
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(c(c1)Cl)C)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 C15H13ClN4O5 MW 364.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClN4O5/c1-3-25-15(23)11-10-12(20(17-11)18-24)14(22)19(13(10)21)8-5-4-7(2)9(16)6-8/h4-6,10,12H,3H2,1-2H3InChIKey
LNBHNJBXJRJWQB-UHFFFAOYSA-NSynonyms
1008963-39-01008963390
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)N=O
ethyl5(3chloro4methylphenyl)1nitroso46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(3CHLORO4METHYLPHENYL)1NITROSO46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC15H13ClN4O5c132515(23)111012(20(1711)1824)14(22)19(13(10)21)8547(2)9(16)68h461012H3H212H3
MFCD03692086
ZINC000005068376
ZINC000101017574
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