Vitas-M small molecule compound
{4-bromo-2-[(Z)-{3-[2-(4-methylphenyl)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}acetic acid
Catalog ID
STL369066
SMILES OC(=O)COc1ccc(cc1/C=C/1\SC(=O)N(C1=O)CC(=O)c1ccc(cc1)C)Br
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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 C21H16BrNO6S MW 490.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO6S/c1-12-2-4-13(5-3-12)16(24)10-23-20(27)18(30-21(23)28)9-14-8-15(22)6-7-17(14)29-11-19(25)26/h2-9H,10-11H2,1H3,(H,25,26)/b18-9-InChIKey
PBXVVHWUMFFEAG-NVMNQCDNSA-NSynonyms
(4bromo2((Z)(3(2(4methylphenyl)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)aceticacid
2(4BROMO2((Z)(3(2(4METHYLPHENYL)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETICACID
CC1=CC=C(C=C1)C(=O)CN2C(=O)C(=CC3=C(C=CC(=C3)Br)OCC(=O)O)SC2=O
InChI=1SC21H16BrNO6Sc1122413(5312)16(24)102320(27)18(3021(23)28)914815(22)6717(14)291119(25)26h29H1011H21H3(H2526)b189
MFCD03705045
OC(=O)COc1ccc(cc1C=C1SC(=O)N(C1=O)CC(=O)c1ccc(cc1)C)Br
ZINC000002938563
ZINC2938563
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