Vitas-M small molecule compound
2-({methyl[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]amino}methyl)-4-oxo-4-{[3-(trifluoromethyl)phenyl]amino}butanoic acid
Catalog ID
STL155916
SMILES O=C(CC(C(=O)O)CN(Cc1c(C)nn(c1C)C)C)Nc1cccc(c1)C(F)(F)F
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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 C20H25F3N4O3 MW 426.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25F3N4O3/c1-12-17(13(2)27(4)25-12)11-26(3)10-14(19(29)30)8-18(28)24-16-7-5-6-15(9-16)20(21,22)23/h5-7,9,14H,8,10-11H2,1-4H3,(H,24,28)(H,29,30)InChIKey
YDLOAGMPHSVHKW-UHFFFAOYSA-NSynonyms
1324091-36-21324091362
2((methyl((135trimethyl1Hpyrazol4yl)methyl)amino)methyl)4oxo4((3(trifluoromethyl)phenyl)amino)butanoicacid
2((methyl((135trimethylpyrazol4yl)methyl)amino)methyl)4oxo4(3(trifluoromethyl)anilino)butanoicacid
CC1=C(C(=NN1C)C)CN(C)CC(CC(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)O
InChI=1SC20H25F3N4O3c11217(13(2)27(4)2512)1126(3)1014(19(29)30)818(28)241675615(916)20(2122)23h57914H81011H214H3(H2428)(H2930)
MFCD19708593
ZINC000071279902
ZINC000071279903
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