Vitas-M small molecule compound
2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[1-(2-chloro-4-fluorobenzyl)-1H-1,2,4-triazol-3-yl]acetamide
Catalog ID
STK307551
SMILES O=C(Cn1nc(c(c1C1CC1)Br)C(F)(F)F)Nc1ncn(n1)Cc1ccc(cc1Cl)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 C18H14BrClF4N6O MW 521.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14BrClF4N6O/c19-14-15(9-1-2-9)30(27-16(14)18(22,23)24)7-13(31)26-17-25-8-29(28-17)6-10-3-4-11(21)5-12(10)20/h3-5,8-9H,1-2,6-7H2,(H,26,28,31)InChIKey
MIMLIXOVSBMYNT-UHFFFAOYSA-NSynonyms
1005564-06-61005564066
2(4bromo5cyclopropyl3(trifluoromethyl)1Hpyrazol1yl)N(1(2chloro4fluorobenzyl)1H124triazol3yl)acetamide
2(4bromo5cyclopropyl3(trifluoromethyl)pyrazol1yl)N(1((2chloro4fluorophenyl)methyl)124triazol3yl)acetamide
C1CC1C2=C(C(=NN2CC(=O)NC3=NN(C=N3)CC4=C(C=C(C=C4)F)Cl)C(F)(F)F)Br
InChI=1SC18H14BrClF4N6Oc191415(9129)30(2716(14)18(2223)24)713(31)261725829(2817)6103411(21)512(10)20h3589H1267H2(H262831)
MFCD04053273
ZINC000002793924
ZINC2793924
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