Vitas-M small molecule compound

benzyl 5-benzyl-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Catalog ID
STK709767
SMILES O=C1N(Cc2ccccc2)C(=O)C2C1NN=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 C20H17N3O4 MW 363.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O4/c24-18-15-16(19(25)23(18)11-13-7-3-1-4-8-13)21-22-17(15)20(26)27-12-14-9-5-2-6-10-14/h1-10,15-16,21H,11-12H2
InChIKey
MHIGYURNGXWTCZ-UHFFFAOYSA-N
Synonyms
957037-30-8
957037308
benzyl5benzyl46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
BENZYL5BENZYL46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
C1=CC=C(C=C1)CN2C(=O)C3C(C2=O)NN=C3C(=O)OCC4=CC=CC=C4
InChI=1SC20H17N3O4c24181516(19(25)23(18)11137314813)212217(15)20(26)27121495261014h110151621H1112H2
MFCD04192813
ZINC000004694752
ZINC000100170925

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Available files

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