Vitas-M small molecule compound
methyl [(5E)-5-{3,5-dibromo-4-[(3-methylbenzyl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK152956
SMILES COC(=O)CN1C(=O)S/C(=C/c2cc(Br)c(c(c2)Br)OCc2cccc(c2)C)/C1=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 C21H17Br2NO5S MW 555.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Br2NO5S/c1-12-4-3-5-13(6-12)11-29-19-15(22)7-14(8-16(19)23)9-17-20(26)24(21(27)30-17)10-18(25)28-2/h3-9H,10-11H2,1-2H3/b17-9+InChIKey
OHWPADDTMWHMOZ-RQZCQDPDSA-NSynonyms
CC1=CC(=CC=C1)COC2=C(C=C(C=C2Br)C=C3C(=O)N(C(=O)S3)CC(=O)OC)Br
COC(=O)CN1C(=O)SC(=Cc2cc(Br)c(c(c2)Br)OCc2cccc(c2)C)C1=O
InChI=1SC21H17Br2NO5Sc11243513(612)11291915(22)714(816(19)23)91720(26)24(21(27)3017)1018(25)282h39H1011H212H3b179+
METHYL((5E)5(35DIBROMO4((3METHYLBENZYL)OXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL(5(35DIBROMO4((3METHYLBENZYL)OXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL2((5E)5((35DIBROMO4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
MFCD03700089
ZINC000002184036
ZINC02184036
ZINC2184036
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