Vitas-M small molecule compound
methyl (2-bromo-4-{(E)-[3-(2-ethoxy-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-6-methoxyphenoxy)acetate
Catalog ID
STK152430
SMILES CCOC(=O)CN1C(=O)S/C(=C/c2cc(Br)c(c(c2)OC)OCC(=O)OC)/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 C18H18BrNO8S MW 488.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrNO8S/c1-4-27-14(21)8-20-17(23)13(29-18(20)24)7-10-5-11(19)16(12(6-10)25-2)28-9-15(22)26-3/h5-7H,4,8-9H2,1-3H3/b13-7+InChIKey
LJAQAGDSRKGZQM-NTUHNPAUSA-NSynonyms
CCOC(=O)CN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OCC(=O)OC)OC)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2cc(Br)c(c(c2)OC)OCC(=O)OC)C1=O
ETHYL2((5E)5((3BROMO5METHOXY4(2METHOXY2OXOETHOXY)PHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC18H18BrNO8Sc142714(21)82017(23)13(2918(20)24)710511(19)16(12(610)252)28915(22)263h57H489H213H3b137+
METHYL(2BROMO4((E)(3(2ETHOXY2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)6METHOXYPHENOXY)ACETATE
MFCD03727723
ZINC000009259480
ZINC09259480
ZINC9259480
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