Vitas-M small molecule compound
4-[(3-{[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]carbonyl}benzyl)oxy]benzonitrile
Catalog ID
STL178186
SMILES N#Cc1ccc(cc1)OCc1cccc(c1)C(=O)N1N=CCC1(O)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 C19H14F3N3O3 MW 389.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14F3N3O3/c20-19(21,22)18(27)8-9-24-25(18)17(26)15-3-1-2-14(10-15)12-28-16-6-4-13(11-23)5-7-16/h1-7,9-10,27H,8,12H2InChIKey
RICNOGVUDKCODK-UHFFFAOYSA-NSynonyms
832144-00-04((3((5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)carbonyl)benzyl)oxy)benzonitrile
4((3(5hydroxy5(trifluoromethyl)4Hpyrazole1carbonyl)phenyl)methoxy)benzonitrile
832144000
C1C=NN(C1(C(F)(F)F)O)C(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)C#N
InChI=1SC19H14F3N3O3c2019(2122)18(27)892425(18)17(26)1531214(1015)1228166413(1123)5716h1791027H812H2
MFCD04059473
ZINC000006828799
ZINC000006828801
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