Vitas-M small molecule compound

ethyl 3,3,3-trifluoro-2-hydroxy-2-{4-[(3-{[(3-nitrophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]phenyl}propanoate

Catalog ID
STK534262
SMILES CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)Nc1nc2ccccc2nc1NS(=O)(=O)c1cccc(c1)[N+](=O)[O-])O

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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 C25H20F3N5O7S MW 591.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20F3N5O7S/c1-2-40-23(34)24(35,25(26,27)28)15-10-12-16(13-11-15)29-21-22(31-20-9-4-3-8-19(20)30-21)32-41(38,39)18-7-5-6-17(14-18)33(36)37/h3-14,35H,2H2,1H3,(H,29,30)(H,31,32)
InChIKey
ONZDELYGNQCEJM-UHFFFAOYSA-N
Synonyms

CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)Nc1nc2ccccc2nc1NS(=O)(=O)c1cccc(c1)(N+)(=O)(O))O
CCOC(=O)C(C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)(N+)(=O)(O))(C(F)(F)F)O
ethyl333trifluoro2hydroxy2(4((3(((3nitrophenyl)sulfonyl)amino)quinoxalin2yl)amino)phenyl)propanoate
ETHYL333TRIFLUORO2HYDROXY2(4((3((3NITROPHENYL)SULFONYLAMINO)QUINOXALIN2YL)AMINO)PHENYL)PROPANOATE
ethyl333trifluoro2hydroxy2(4((3(3nitrophenylsulfonamido)quinoxalin2yl)amino)phenyl)propanoate
InChI=1SC25H20F3N5O7Sc124023(34)24(3525(2627)28)15101216(131115)292122(3120943819(20)3021)3241(3839)1875617(1418)33(36)37h31435H2H21H3(H2930)(H3132)
MFCD01853846
ZINC000102414105
ZINC000102414110

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Available files

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