Vitas-M small molecule compound
(7Z)-7-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-(difluoromethyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Catalog ID
STL177149
SMILES Brc1cc2OCOc2cc1/C=c/1\sc2nnc(n2nc1C)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 C14H9BrF2N4O2S MW 415.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9BrF2N4O2S/c1-6-11(24-14-19-18-13(12(16)17)21(14)20-6)3-7-2-9-10(4-8(7)15)23-5-22-9/h2-4,12H,5H2,1H3/b11-3-InChIKey
VWZAEQGKXZWEAD-JYOAFUTRSA-NSynonyms
(7Z)7((6BROMO13BENZODIOXOL5YL)METHYLIDENE)3(DIFLUOROMETHYL)6METHYL(124)TRIAZOLO(34B)(134)THIADIAZINE
(7Z)7((6bromo13benzodioxol5yl)methylidene)3(difluoromethyl)6methyl7H(124)triazolo(34b)(134)thiadiazine
Brc1cc2OCOc2cc1C=c1sc2nnc(n2nc1C)C(F)F
CC1=NN2C(=NN=C2SC1=CC3=CC4=C(C=C3Br)OCO4)C(F)F
InChI=1SC14H9BrF2N4O2Sc1611(2414191813(12(16)17)21(14)206)372910(48(7)15)235229h2412H5H21H3b113
MFCD04051566
ZINC000020608396
ZINC20608396
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