Vitas-M small molecule compound

5-bromo-1-(2,5-dimethylbenzyl)-3-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-one

Catalog ID
STK272829
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)CC1(O)C(=O)N(c2c1cc(Br)cc2)Cc1cc(C)ccc1C

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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 C26H23BrN2O6 MW 539.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN2O6/c1-15-4-5-16(2)18(10-15)14-28-21-8-7-19(27)12-20(21)26(32,25(28)31)13-23(30)17-6-9-24(35-3)22(11-17)29(33)34/h4-12,32H,13-14H2,1-3H3
InChIKey
YFVQOJICHBIBOJ-UHFFFAOYSA-N
Synonyms

1((25DIMETHYLPHENYL)METHYL)5BROMO3HYDROXY3(2(4METHOXY3NITROPHENYL)2OXOETHYL)INDOLIN2ONE
5BROMO1((25DIMETHYLPHENYL)METHYL)3HYDROXY3(2(4METHOXY3NITROPHENYL)2OXOETHYL)INDOL2ONE
5bromo1(25dimethylbenzyl)3hydroxy3(2(4methoxy3nitrophenyl)2oxoethyl)13dihydro2Hindol2one
CC1=CC(=C(C=C1)C)CN2C3=C(C=C(C=C3)Br)C(C2=O)(CC(=O)C4=CC(=C(C=C4)OC)(N+)(=O)(O))O
COc1ccc(cc1(N+)(=O)(O))C(=O)CC1(O)C(=O)N(c2c1cc(Br)cc2)Cc1cc(C)ccc1C
InChI=1SC26H23BrN2O6c1154516(2)18(1015)1428218719(27)1220(21)26(3225(28)31)1323(30)176924(353)22(1117)29(33)34h41232H1314H213H3
MFCD05661446
ZINC000102099687
ZINC000102099690

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Available files

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