Vitas-M small molecule compound

methyl 3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-3-(3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)propanoate

Catalog ID
STL543498
SMILES COC(=O)CC(C1=C(O)C(=O)c2c(C1=O)cccc2)c1ccc2c(c1)n(C)c(=O)n2C

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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 C23H20N2O6 MW 420.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O6/c1-24-16-9-8-12(10-17(16)25(2)23(24)30)15(11-18(26)31-3)19-20(27)13-6-4-5-7-14(13)21(28)22(19)29/h4-10,15,29H,11H2,1-3H3
InChIKey
CDVOUPGHPMYYJG-UHFFFAOYSA-N
Synonyms

InChI=1SC23H20N2O6c124169812(1017(16)25(2)23(24)30)15(1118(26)313)1920(27)13645714(13)21(28)22(19)29h4101529H11H213H3
methyl3(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)3(3hydroxy14dioxo14dihydronaphthalen2yl)propanoate
methyl3(13dimethyl2oxo23dihydro1Hbenzo(d)imidazol5yl)3(3hydroxy14dioxo14dihydronaphthalen2yl)propanoate
MFCD28349148
ZINC000217697368
ZINC000217697441

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Available files

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