Vitas-M small molecule compound
2-amino-4-{4-methoxy-3-[(pentafluorophenoxy)methyl]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL173035
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)COc1c(F)c(F)c(c(c1F)F)F)OC)C(=O)CC(C2)(C)C
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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 C26H21F5N2O4 MW 520.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21F5N2O4/c1-26(2)7-14(34)18-16(8-26)37-25(33)13(9-32)17(18)11-4-5-15(35-3)12(6-11)10-36-24-22(30)20(28)19(27)21(29)23(24)31/h4-6,17H,7-8,10,33H2,1-3H3InChIKey
UWGNBDWBDQMFIM-UHFFFAOYSA-NSynonyms
514816-39-82amino4(4methoxy3((23456pentafluorophenoxy)methyl)phenyl)77dimethyl5oxo68dihydro4Hchromene3carbonitrile
2amino4(4methoxy3((pentafluorophenoxy)methyl)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
514816398
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OC)COC4=C(C(=C(C(=C4F)F)F)F)F)C(=O)C1)C
InChI=1SC26H21F5N2O4c126(2)714(34)1816(826)3725(33)13(932)17(18)114515(353)12(611)10362422(30)20(28)19(27)21(29)23(24)31h4617H781033H213H3
MFCD02175218
ZINC000002114949
ZINC000002114951
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