Vitas-M small molecule compound
2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Catalog ID
STK838571
SMILES O=C(N1CCc2c(C1)cccc2)Cn1nc(c(c1C)Br)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 C16H15BrF3N3O MW 402.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrF3N3O/c1-10-14(17)15(16(18,19)20)21-23(10)9-13(24)22-7-6-11-4-2-3-5-12(11)8-22/h2-5H,6-9H2,1H3InChIKey
KVOUPYWUBUIKJL-UHFFFAOYSA-NSynonyms
357611-65-52(4bromo5methyl3(trifluoromethyl)1Hpyrazol1yl)1(34dihydroisoquinolin2(1H)yl)ethanone
2(4BROMO5METHYL3(TRIFLUOROMETHYL)PYRAZOL1YL)1(34DIHYDRO1HISOQUINOLIN2YL)ETHANONE
357611655
CC1=C(C(=NN1CC(=O)N2CCC3=CC=CC=C3C2)C(F)(F)F)Br
InChI=1SC16H15BrF3N3Oc11014(17)15(16(1819)20)2123(10)913(24)227611423512(11)822h25H69H21H3
MFCD01451857
ZINC000000845151
ZINC00845151
ZINC845151
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