Vitas-M small molecule compound
3-{(5E)-5-[3-bromo-4-(propan-2-yloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoic acid
Catalog ID
STK124731
SMILES CC(Oc1ccc(cc1Br)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)C(=O)O)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 C20H16BrNO4S2 MW 478.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrNO4S2/c1-11(2)26-16-7-6-12(8-15(16)21)9-17-18(23)22(20(27)28-17)14-5-3-4-13(10-14)19(24)25/h3-11H,1-2H3,(H,24,25)/b17-9+InChIKey
ZAZRASAFHIJPME-RQZCQDPDSA-NSynonyms
3((5E)5((3BROMO4PROPAN2YLOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOICACID
3((5E)5(3BROMO4(PROPAN2YLOXY)BENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BENZOICACID
CC(C)OC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)O)Br
CC(Oc1ccc(cc1Br)C=C1SC(=S)N(C1=O)c1cccc(c1)C(=O)O)C
InChI=1SC20H16BrNO4S2c111(2)26167612(815(16)21)91718(23)22(20(27)2817)1453413(1014)19(24)25h311H12H3(H2425)b179+
MFCD03994005
ZINC000002828808
ZINC2828808
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