Vitas-M small molecule compound
ethyl 5-(4-methylphenyl)-4,6-dioxo-1-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK865583
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)C)c1ccccc1
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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 C21H19N3O4 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4/c1-3-28-21(27)17-16-18(24(22-17)15-7-5-4-6-8-15)20(26)23(19(16)25)14-11-9-13(2)10-12-14/h4-12,16,18H,3H2,1-2H3InChIKey
VIFGIENITNDIBZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)C)C4=CC=CC=C4
ethyl46dioxo1phenyl5(ptolyl)13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ethyl5(4methylphenyl)46dioxo1phenyl13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(4METHYLPHENYL)46DIOXO1PHENYL3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC21H19N3O4c132821(27)171618(24(2217)157546815)20(26)23(19(16)25)1411913(2)101214h4121618H3H212H3
MFCD02239783
ZINC000004811521
ZINC000100563750
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