Vitas-M small molecule compound
benzyl 5-(4-bromophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK988298
SMILES Brc1ccc(cc1)N1C(=O)C2C(C1=O)NN=C2C(=O)OCc1ccccc1
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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 C19H14BrN3O4 MW 428.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrN3O4/c20-12-6-8-13(9-7-12)23-17(24)14-15(18(23)25)21-22-16(14)19(26)27-10-11-4-2-1-3-5-11/h1-9,14-15,21H,10H2InChIKey
IXCBXTHFNJSSIN-UHFFFAOYSA-NSynonyms
958942-47-7958942477
benzyl5(4bromophenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
BENZYL5(4BROMOPHENYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
C1=CC=C(C=C1)COC(=O)C2=NNC3C2C(=O)N(C3=O)C4=CC=C(C=C4)Br
InChI=1SC19H14BrN3O4c20126813(9712)2317(24)1415(18(23)25)212216(14)19(26)2710114213511h19141521H10H2
MFCD04154452
ZINC000009191663
ZINC000101076314
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