Vitas-M small molecule compound
6-(3-bromo-4-fluorophenyl)-3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK621293
SMILES COc1cc(ccc1OC)c1nnc2n1nc(s2)c1ccc(c(c1)Br)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 C17H12BrFN4O2S MW 435.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrFN4O2S/c1-24-13-6-4-9(8-14(13)25-2)15-20-21-17-23(15)22-16(26-17)10-3-5-12(19)11(18)7-10/h3-8H,1-2H3InChIKey
XDUOFYQTMMBNCY-UHFFFAOYSA-NSynonyms
929856-14-46(3bromo4fluorophenyl)3(34dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
929856144
COC1=C(C=C(C=C1)C2=NN=C3N2N=C(S3)C4=CC(=C(C=C4)F)Br)OC
InChI=1SC17H12BrFN4O2Sc12413649(814(13)252)1520211723(15)2216(2617)103512(19)11(18)710h38H12H3
MFCD09792122
ZINC000009575858
ZINC09575858
ZINC9575858
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