Vitas-M small molecule compound
ethyl 1,5-bis(4-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK865584
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)C)c1ccc(cc1)C
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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 C22H21N3O4 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4/c1-4-29-22(28)18-17-19(25(23-18)16-11-7-14(3)8-12-16)21(27)24(20(17)26)15-9-5-13(2)6-10-15/h5-12,17,19H,4H2,1-3H3InChIKey
HWABDGNIOJVAKM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C
ethyl15bis(4methylphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL15BIS(4METHYLPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
ethyl46dioxo15diptolyl13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
InChI=1SC22H21N3O4c142922(28)181719(25(2318)1611714(3)81216)21(27)24(20(17)26)159513(2)61015h5121719H4H213H3
MFCD02239011
ZINC000004863250
ZINC000100563758
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