Vitas-M small molecule compound

(2Z)-2-(1H-benzimidazol-2-yl)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-hydroxypent-2-enenitrile

Catalog ID
STK563982
SMILES N#C/C(=C(\C(N1C(=O)c2c(C1=O)cccc2)C)/O)/c1nc2c([nH]1)cccc2

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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 C20H14N4O3 MW 358.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O3/c1-11(24-19(26)12-6-2-3-7-13(12)20(24)27)17(25)14(10-21)18-22-15-8-4-5-9-16(15)23-18/h2-9,11,25H,1H3,(H,22,23)/b17-14-
InChIKey
NMBBWGPJVBCVQU-VKAVYKQESA-N
Synonyms
332848-82-5
332848825
MFCD03810856
N#CC(=C(C(N1C(=O)c2c(C1=O)cccc2)C)O)c1nc2c((nH)1)cccc2
ZINC000102524951
ZINC000102524959

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Available files

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