Vitas-M small molecule compound
methyl 2-{(5E)-5-[2-bromo-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate
Catalog ID
STK155257
SMILES COC(=O)COc1cc(Br)c(cc1OC)/C=C\1/SC(=O)N(C1=O)C(C(=O)OC)C
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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 C18H18BrNO8S MW 488.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrNO8S/c1-9(17(23)27-4)20-16(22)14(29-18(20)24)6-10-5-12(25-2)13(7-11(10)19)28-8-15(21)26-3/h5-7,9H,8H2,1-4H3/b14-6+InChIKey
XTTQJTPPYFUYHK-MKMNVTDBSA-NSynonyms
CC(C(=O)OC)N1C(=O)C(=CC2=CC(=C(C=C2Br)OCC(=O)OC)OC)SC1=O
COC(=O)COc1cc(Br)c(cc1OC)C=C1SC(=O)N(C1=O)C(C(=O)OC)C
InChI=1SC18H18BrNO8Sc19(17(23)274)2016(22)14(2918(20)24)610512(252)13(711(10)19)28815(21)263h579H8H214H3b146+
METHYL2((5E)5((2BROMO5METHOXY4(2METHOXY2OXOETHOXY)PHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
METHYL2((5E)5(2BROMO5METHOXY4(2METHOXY2OXOETHOXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
MFCD03923101
ZINC000013881399
ZINC000013881401
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