Vitas-M small molecule compound
{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}[5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone
Catalog ID
STK310336
SMILES Clc1ccc(c(c1)Br)OCn1ccc(n1)C(=O)N1N=C(CC1(O)C(F)F)C
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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 C16H14BrClF2N4O3 MW 463.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrClF2N4O3/c1-9-7-16(26,15(19)20)24(21-9)14(25)12-4-5-23(22-12)8-27-13-3-2-10(18)6-11(13)17/h2-6,15,26H,7-8H2,1H3InChIKey
YVJPCOQBKIAXKV-UHFFFAOYSA-NSynonyms
1005595-59-4(1((2bromo4chlorophenoxy)methyl)1Hpyrazol3yl)(5(difluoromethyl)5hydroxy3methyl45dihydro1Hpyrazol1yl)methanone
(1((2bromo4chlorophenoxy)methyl)pyrazol3yl)(5(difluoromethyl)5hydroxy3methyl4Hpyrazol1yl)methanone
1005595594
CC1=NN(C(C1)(C(F)F)O)C(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)Cl)Br
InChI=1SC16H14BrClF2N4O3c19716(2615(19)20)24(219)14(25)124523(2212)827133210(18)611(13)17h261526H78H21H3
MFCD04053923
ZINC000013960103
ZINC000013960104
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