Vitas-M small molecule compound
ethyl 4,6-dioxo-5-(2,4,6-trichlorophenyl)-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK709836
SMILES CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1c(Cl)cc(cc1Cl)Cl
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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 C14H10Cl3N3O4 MW 390.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10Cl3N3O4/c1-2-24-14(23)10-8-9(18-19-10)13(22)20(12(8)21)11-6(16)3-5(15)4-7(11)17/h3-4,8-9,18H,2H2,1H3InChIKey
AVPKVNBOYKJPTA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NNC2C1C(=O)N(C2=O)C3=C(C=C(C=C3Cl)Cl)Cl
ethyl46dioxo5(246trichlorophenyl)13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL46DIOXO5(246TRICHLOROPHENYL)3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC14H10Cl3N3O4c122414(23)1089(181910)13(22)20(12(8)21)116(16)35(15)47(11)17h348918H2H21H3
MFCD04405148
ZINC000004698569
ZINC000100177515
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