Vitas-M small molecule compound

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

Catalog ID
STL005440
SMILES COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1

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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/c1-27-19(26)15-14-16(23(21-15)13-5-3-2-4-6-13)18(25)22(17(14)24)12-9-7-11(20)8-10-12/h2-10,14,16H,1H3
InChIKey
YFSJRTTWSAIOHL-UHFFFAOYSA-N
Synonyms
1022851-69-9
1022851699
COC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4
InChI=1SC19H14BrN3O4c12719(26)151416(23(2115)135324613)18(25)22(17(14)24)129711(20)81012h2101416H1H3
methyl5(4bromophenyl)46dioxo1phenyl13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(4BROMOPHENYL)46DIOXO1PHENYL3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD03671553
ZINC000017949703
ZINC000100943178

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Available files

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