Vitas-M small molecule compound
(5E)-5-(3-bromobenzylidene)-2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK704580
SMILES Fc1ccc(cc1)c1nn2c(n1)s/c(=C/c1cccc(c1)Br)/c2=O
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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 C17H9BrFN3OS MW 402.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9BrFN3OS/c18-12-3-1-2-10(8-12)9-14-16(23)22-17(24-14)20-15(21-22)11-4-6-13(19)7-5-11/h1-9H/b14-9+InChIKey
BXDSVKOXONFJKM-NTEUORMPSA-NSynonyms
(5E)5((3BROMOPHENYL)METHYLIDENE)2(4FLUOROPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(3bromobenzylidene)2(4fluorophenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(3bromobenzylidene)2(4fluorophenyl)thiazolo(32b)(124)triazol6(5H)one
C1=CC(=CC(=C1)Br)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)F)S2
Fc1ccc(cc1)c1nn2c(n1)sc(=Cc1cccc(c1)Br)c2=O
InChI=1SC17H9BrFN3OSc181231210(812)91416(23)2217(2414)2015(2122)114613(19)7511h19Hb149+
MFCD04446586
ZINC000002445635
ZINC02445635
ZINC2445635
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