Vitas-M small molecule compound
(5E)-5-(2-bromobenzylidene)-2-(3-methyl-1-benzofuran-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK816247
SMILES Brc1ccccc1/C=c\1/sc2n(c1=O)nc(n2)c1oc2c(c1C)cccc2
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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 C20H12BrN3O2S MW 438.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12BrN3O2S/c1-11-13-7-3-5-9-15(13)26-17(11)18-22-20-24(23-18)19(25)16(27-20)10-12-6-2-4-8-14(12)21/h2-10H,1H3/b16-10+InChIKey
KTCCLZNSDAEOGR-MHWRWJLKSA-NSynonyms
(5E)5((2bromophenyl)methylidene)2(3methyl1benzofuran2yl)(13)thiazolo(32b)(124)triazol6one
(5E)5(2bromobenzylidene)2(3methyl1benzofuran2yl)(13)thiazolo(32b)(124)triazol6(5H)one
Brc1ccccc1C=c1sc2n(c1=O)nc(n2)c1oc2c(c1C)cccc2
CC1=C(OC2=CC=CC=C12)C3=NN4C(=O)C(=CC5=CC=CC=C5Br)SC4=N3
InChI=1SC20H12BrN3O2Sc11113735915(13)2617(11)18222024(2318)19(25)16(2720)1012624814(12)21h210H1H3b1610+
MFCD04446021
ZINC000026531939
ZINC26531939
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