Vitas-M small molecule compound

methyl 5'-acetyl-2'-amino-5-bromo-2-oxo-6'-phenyl-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate

Catalog ID
STL570420
SMILES COC(=O)C1=C(N)OC(=C(C21C(=O)Nc1c2cc(Br)cc1)C(=O)C)c1ccccc1

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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 C22H17BrN2O5 MW 469.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN2O5/c1-11(26)16-18(12-6-4-3-5-7-12)30-19(24)17(20(27)29-2)22(16)14-10-13(23)8-9-15(14)25-21(22)28/h3-10H,24H2,1-2H3,(H,25,28)
InChIKey
YUAIYPHHPQAJOT-UHFFFAOYSA-N
Synonyms
330158-86-6
3125777
330158866
InChI=1SC22H17BrN2O5c111(26)1618(126435712)3019(24)17(20(27)292)22(16)141013(23)8915(14)2521(22)28h310H24H212H3(H2528)
methyl3acetyl6amino5bromo2oxo2phenylspiro(indoline34pyran)5carboxylate
methyl5acetyl2amino5bromo2oxo6phenyl12dihydrospiro(indole34pyran)3carboxylate
methyl5acetyl2amino5bromo2oxo6phenylspiro(1Hindole34pyran)3carboxylate
MFCD01242945
ZINC000000850181
ZINC000000850182

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Available files

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