Vitas-M small molecule compound
ethyl 5-(4-bromophenyl)-4,6-dioxo-1-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL004332
SMILES CCOC(=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 C20H16BrN3O4 MW 442.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrN3O4/c1-2-28-20(27)16-15-17(24(22-16)14-6-4-3-5-7-14)19(26)23(18(15)25)13-10-8-12(21)9-11-13/h3-11,15,17H,2H2,1H3InChIKey
YSXRGUIBWUOMJG-UHFFFAOYSA-NSynonyms
474302-79-9474302799
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4
ethyl5(4bromophenyl)46dioxo1phenyl13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(4BROMOPHENYL)46DIOXO1PHENYL3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC20H16BrN3O4c122820(27)161517(24(2216)146435714)19(26)23(18(15)25)1310812(21)91113h3111517H2H21H3
MFCD01575733
ZINC000009075469
ZINC000100914964
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