Vitas-M small molecule compound

1-benzyl-5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1,3-dihydro-2H-indol-2-one

Catalog ID
STK063997
SMILES COc1ccc(cc1OC)C(=O)CC1(O)C(=O)N(c2c1cc(Br)cc2)Cc1ccccc1

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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 C25H22BrNO5 MW 496.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrNO5/c1-31-22-11-8-17(12-23(22)32-2)21(28)14-25(30)19-13-18(26)9-10-20(19)27(24(25)29)15-16-6-4-3-5-7-16/h3-13,30H,14-15H2,1-2H3
InChIKey
XECVJQALBJGKFR-UHFFFAOYSA-N
Synonyms

1BENZYL5BROMO3(2(34DIMETHOXYPHENYL)2OXOETHYL)3HYDROXY13DIHYDRO2HINDOL2ONE
1BENZYL5BROMO3(2(34DIMETHOXYPHENYL)2OXOETHYL)3HYDROXYINDOL2ONE
COC1=C(C=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4)O)OC
COc1ccc(cc1OC)C(=O)CC1(O)C(=O)N(c2c1cc(Br)cc2)Cc1ccccc1
InChI=1SC25H22BrNO5c1312211817(1223(22)322)21(28)1425(30)191318(26)91020(19)27(24(25)29)15166435716h31330H1415H212H3
MFCD03721839
STK063997
ZINC000009553744
ZINC000013897358

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Available files

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