Vitas-M small molecule compound
ethyl 5-(3-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK753390
SMILES CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1cccc(c1)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 C15H15N3O4 MW 301.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O4/c1-3-22-15(21)12-10-11(16-17-12)14(20)18(13(10)19)9-6-4-5-8(2)7-9/h4-7,10-11,16H,3H2,1-2H3InChIKey
PTCQESBPQMEHJX-UHFFFAOYSA-NSynonyms
82239-83-682239836
CCOC(=O)C1=NNC2C1C(=O)N(C2=O)C3=CC=CC(=C3)C
ethyl46dioxo5(mtolyl)13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ethyl5(3methylphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(3METHYLPHENYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC15H15N3O4c132215(21)121011(161712)14(20)18(13(10)19)96458(2)79h47101116H3H212H3
MFCD00685596
ZINC000004369223
ZINC000100048930
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