Vitas-M small molecule compound
(5Z)-5-(2-bromobenzylidene)-2-[(E)-2-(4-methoxyphenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904863
SMILES COc1ccc(cc1)/C=C/c1nn2c(n1)s/c(=C\c1ccccc1Br)/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 C20H14BrN3O2S MW 440.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN3O2S/c1-26-15-9-6-13(7-10-15)8-11-18-22-20-24(23-18)19(25)17(27-20)12-14-4-2-3-5-16(14)21/h2-12H,1H3/b11-8+,17-12-InChIKey
XHAMGHLRFKVSSP-JUBDITTISA-NSynonyms
(5Z)5((2bromophenyl)methylidene)2((E)2(4methoxyphenyl)ethenyl)(13)thiazolo(32b)(124)triazol6one
(5Z)5(2bromobenzylidene)2((E)2(4methoxyphenyl)ethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
COC1=CC=C(C=C1)C=CC2=NN3C(=O)C(=CC4=CC=CC=C4Br)SC3=N2
COc1ccc(cc1)C=Cc1nn2c(n1)sc(=Cc1ccccc1Br)c2=O
InChI=1SC20H14BrN3O2Sc126159613(71015)81118222024(2318)19(25)17(2720)1214423516(14)21h212H1H3b118+1712
MFCD07478942
ZINC000027022528
ZINC27022528
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