Vitas-M small molecule compound
2-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK961428
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)COc1cccc(c1)C(F)(F)F)OC)C(=O)CCC2
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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 C25H21F3N2O4 MW 470.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21F3N2O4/c1-32-20-9-8-14(10-15(20)13-33-17-5-2-4-16(11-17)25(26,27)28)22-18(12-29)24(30)34-21-7-3-6-19(31)23(21)22/h2,4-5,8-11,22H,3,6-7,13,30H2,1H3InChIKey
DOODYHJAUCHUQK-UHFFFAOYSA-NSynonyms
445236-68-02amino4(4methoxy3((3(trifluoromethyl)phenoxy)methyl)phenyl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(4methoxy3((3(trifluoromethyl)phenoxy)methyl)phenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
445236680
COC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)COC4=CC=CC(=C4)C(F)(F)F
InChI=1SC25H21F3N2O4c132209814(1015(20)13331752416(1117)25(2627)28)2218(1229)24(30)342173619(31)23(21)22h24581122H3671330H21H3
MFCD02373947
ZINC000000649348
ZINC000002774710
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