Vitas-M small molecule compound
ethyl 5-(4-bromophenyl)-1-(2-chlorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK997825
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1Cl
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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 C20H15BrClN3O4 MW 476.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrClN3O4/c1-2-29-20(28)16-15-17(25(23-16)14-6-4-3-5-13(14)22)19(27)24(18(15)26)12-9-7-11(21)8-10-12/h3-10,15,17H,2H2,1H3InChIKey
CNNIWPBRDQVNGH-UHFFFAOYSA-NSynonyms
1022613-84-81022613848
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4Cl
ethyl5(4bromophenyl)1(2chlorophenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(4BROMOPHENYL)1(2CHLOROPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC20H15BrClN3O4c122920(28)161517(25(2316)14643513(14)22)19(27)24(18(15)26)129711(21)81012h3101517H2H21H3
MFCD03670530
ZINC000013658438
ZINC000100937432
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