Vitas-M small molecule compound
(5Z)-5-(5-bromo-2-methoxybenzylidene)-2-[(E)-2-phenylethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904302
SMILES COc1ccc(cc1/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccccc1)Br
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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 C20H14BrN3O2S MW 440.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN3O2S/c1-26-16-9-8-15(21)11-14(16)12-17-19(25)24-20(27-17)22-18(23-24)10-7-13-5-3-2-4-6-13/h2-12H,1H3/b10-7+,17-12-InChIKey
WYOMRXGQMUQCLH-VXGMZCCXSA-NSynonyms
(5Z)5((5bromo2methoxyphenyl)methylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6one
(5Z)5(5bromo2methoxybenzylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
COC1=C(C=C(C=C1)Br)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=CC=C4)S2
COc1ccc(cc1C=c1sc2n(c1=O)nc(n2)C=Cc1ccccc1)Br
InChI=1SC20H14BrN3O2Sc126169815(21)1114(16)121719(25)2420(2717)2218(2324)107135324613h212H1H3b107+1712
MFCD18076035
ZINC000027021777
ZINC27021777
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