Vitas-M small molecule compound

ethyl 5-(2,4-dimethylphenyl)-4,6-dioxo-2,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Catalog ID
STK759534
SMILES CCOC(=O)c1[nH]nc2c1c(=O)n(c2=O)c1ccc(cc1C)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 C16H15N3O4 MW 313.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O4/c1-4-23-16(22)13-11-12(17-18-13)15(21)19(14(11)20)10-6-5-8(2)7-9(10)3/h5-7H,4H2,1-3H3,(H,17,18)
InChIKey
WBZILDZSJZSTDD-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)nc2c1c(=O)n(c2=O)c1ccc(cc1C)C
CCOC(=O)C1=C2C(=NN1)C(=O)N(C2=O)C3=C(C=C(C=C3)C)C
ethyl5(24dimethylphenyl)46dioxo2456tetrahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(24DIMETHYLPHENYL)46DIOXO2HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC16H15N3O4c142316(22)131112(171813)15(21)19(14(11)20)10658(2)79(10)3h57H4H213H3(H1718)
MFCD07021520
ZINC000085696825
ZINC04565199
ZINC85696825

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.