Vitas-M small molecule compound
(2Z)-2-{3-bromo-5-ethoxy-4-[(4-fluorobenzyl)oxy]benzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK044122
SMILES CCOc1cc(cc(c1OCc1ccc(cc1)F)Br)/C=c/1\sc2n(c1=O)c1c(n2)cccc1
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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 C25H18BrFN2O3S MW 525.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18BrFN2O3S/c1-2-31-21-12-16(11-18(26)23(21)32-14-15-7-9-17(27)10-8-15)13-22-24(30)29-20-6-4-3-5-19(20)28-25(29)33-22/h3-13H,2,14H2,1H3/b22-13-InChIKey
TXRJCWKZFWKXAG-XKZIYDEJSA-NSynonyms
(2Z)2((3BROMO5ETHOXY4((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(3BROMO5ETHOXY4((4FLUOROBENZYL)OXY)BENZYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)Br)OCC5=CC=C(C=C5)F
CCOc1cc(cc(c1OCc1ccc(cc1)F)Br)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC25H18BrFN2O3Sc1231211216(1118(26)23(21)3214157917(27)10815)132224(30)2920643519(20)2825(29)3322h313H214H21H3b2213
MFCD02122204
STK044122
ZINC000059821602
ZINC59821602
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