Vitas-M small molecule compound
4-[(3-{[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]carbonyl}benzyl)oxy]benzonitrile
Catalog ID
STK967831
SMILES N#Cc1ccc(cc1)OCc1cccc(c1)C(=O)N1N=C(CC1(O)C(F)F)C(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 C20H15F4N3O3 MW 421.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F4N3O3/c21-17(22)16-9-20(29,19(23)24)27(26-16)18(28)14-3-1-2-13(8-14)11-30-15-6-4-12(10-25)5-7-15/h1-8,17,19,29H,9,11H2InChIKey
MZHVMNOOSCACKA-UHFFFAOYSA-NSynonyms
678978-90-04((3((35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)carbonyl)benzyl)oxy)benzonitrile
4((3(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOLE1CARBONYL)PHENYL)METHOXY)BENZONITRILE
678978900
C1C(=NN(C1(C(F)F)O)C(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)C#N)C(F)F
InChI=1SC20H15F4N3O3c2117(22)16920(2919(23)24)27(2616)18(28)1431213(814)1130156412(1025)5715h18171929H911H2
MFCD04048314
ZINC000000652552
ZINC000000652556
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