Vitas-M small molecule compound
benzyl 5-(2,4-dimethylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK988299
SMILES Cc1ccc(c(c1)C)N1C(=O)C2C(C1=O)NN=C2C(=O)OCc1ccccc1
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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/c1-12-8-9-15(13(2)10-12)24-19(25)16-17(20(24)26)22-23-18(16)21(27)28-11-14-6-4-3-5-7-14/h3-10,16-17,22H,11H2,1-2H3InChIKey
RGXWPJYLLYYZKR-UHFFFAOYSA-NSynonyms
958943-94-7958943947
benzyl5(24dimethylphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
BENZYL5(24DIMETHYLPHENYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
CC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)NN=C3C(=O)OCC4=CC=CC=C4)C
InChI=1SC21H19N3O4c1128915(13(2)1012)2419(25)1617(20(24)26)222318(16)21(27)2811146435714h310161722H11H212H3
MFCD04194125
ZINC000004361412
ZINC000100916165
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