Vitas-M small molecule compound
propan-2-yl 4,4,4-trifluoro-2-(2-hydroxy-5-{[(4-methoxy-3-nitrophenyl)sulfonyl]amino}phenyl)-3-oxobutanoate
Catalog ID
STK238391
SMILES COc1ccc(cc1[N+](=O)[O-])S(=O)(=O)Nc1ccc(c(c1)C(C(=O)C(F)(F)F)C(=O)OC(C)C)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 C20H19F3N2O9S MW 520.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N2O9S/c1-10(2)34-19(28)17(18(27)20(21,22)23)13-8-11(4-6-15(13)26)24-35(31,32)12-5-7-16(33-3)14(9-12)25(29)30/h4-10,17,24,26H,1-3H3InChIKey
NOOGNXVJWVNPTJ-UHFFFAOYSA-NSynonyms
CC(C)OC(=O)C(C1=C(C=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O))O)C(=O)C(F)(F)F
COc1ccc(cc1(N+)(=O)(O))S(=O)(=O)Nc1ccc(c(c1)C(C(=O)C(F)(F)F)C(=O)OC(C)C)O
InChI=1SC20H19F3N2O9Sc110(2)3419(28)17(18(27)20(2122)23)13811(4615(13)26)2435(3132)125716(333)14(912)25(29)30h410172426H13H3
MFCD04065140
propan2yl444trifluoro2(2hydroxy5(((4methoxy3nitrophenyl)sulfonyl)amino)phenyl)3oxobutanoate
PROPAN2YL444TRIFLUORO2(2HYDROXY5((4METHOXY3NITROPHENYL)SULFONYLAMINO)PHENYL)3OXOBUTANOATE
ZINC000006142800
ZINC000006142801
Check stock
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Check stock on Vitas-MAvailable files
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