Vitas-M small molecule compound
ethyl 5-(4-ethylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK825802
SMILES CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1ccc(cc1)CC
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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 C16H17N3O4 MW 315.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O4/c1-3-9-5-7-10(8-6-9)19-14(20)11-12(15(19)21)17-18-13(11)16(22)23-4-2/h5-8,11-12,17H,3-4H2,1-2H3InChIKey
TYIZLMGPWRYNPD-UHFFFAOYSA-NSynonyms
850766-87-9850766879
CCC1=CC=C(C=C1)N2C(=O)C3C(C2=O)NN=C3C(=O)OCC
ethyl5(4ethylphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(4ETHYLPHENYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC16H17N3O4c1395710(869)1914(20)1112(15(19)21)171813(11)16(22)2342h58111217H34H212H3
MFCD03255391
ZINC000004872251
ZINC000100905259
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