Vitas-M small molecule compound
methyl 5-(4-bromophenyl)-1-(4-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK843833
SMILES COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccc(cc1)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 C20H16BrN3O5 MW 458.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrN3O5/c1-28-14-9-7-13(8-10-14)24-17-15(16(22-24)20(27)29-2)18(25)23(19(17)26)12-5-3-11(21)4-6-12/h3-10,15,17H,1-2H3InChIKey
VBQBDXBPQRJXRL-UHFFFAOYSA-NSynonyms
1009547-87-81009547878
COC1=CC=C(C=C1)N2C3C(C(=N2)C(=O)OC)C(=O)N(C3=O)C4=CC=C(C=C4)Br
InChI=1SC20H16BrN3O5c128149713(81014)241715(16(2224)20(27)292)18(25)23(19(17)26)125311(21)4612h3101517H12H3
methyl5(4bromophenyl)1(4methoxyphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(4BROMOPHENYL)1(4METHOXYPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD03671174
ZINC000009046473
ZINC000100909516
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