Vitas-M small molecule compound
methyl 5-(4-chlorophenyl)-6a-methyl-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL333111
SMILES COC(=O)C1=NNC2(C1C(=O)N(C2=O)c1ccc(cc1)Cl)C
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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 C14H12ClN3O4 MW 321.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClN3O4/c1-14-9(10(16-17-14)12(20)22-2)11(19)18(13(14)21)8-5-3-7(15)4-6-8/h3-6,9,17H,1-2H3InChIKey
MJVRDYGXWVKTPB-UHFFFAOYSA-NSynonyms
495385-56-3495385563
CC12C(C(=NN1)C(=O)OC)C(=O)N(C2=O)C3=CC=C(C=C3)Cl
InChI=1SC14H12ClN3O4c1149(10(161714)12(20)222)11(19)18(13(14)21)8537(15)468h36917H12H3
methyl5(4chlorophenyl)6amethyl46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(4CHLOROPHENYL)6AMETHYL46DIOXO13ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD03083241
ZINC000000382333
ZINC000004897987
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