Vitas-M small molecule compound
[(5E)-5-{3-ethoxy-4-[(4-fluorobenzyl)oxy]-5-(prop-2-en-1-yl)benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK116264
SMILES CCOc1cc(/C=C\2/SC(=O)N(C2=O)CC(=O)O)cc(c1OCc1ccc(cc1)F)CC=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 C24H22FNO6S MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FNO6S/c1-3-5-17-10-16(12-20-23(29)26(13-21(27)28)24(30)33-20)11-19(31-4-2)22(17)32-14-15-6-8-18(25)9-7-15/h3,6-12H,1,4-5,13-14H2,2H3,(H,27,28)/b20-12+InChIKey
MCSKAOUCHKYYMJ-UDWIEESQSA-NSynonyms
((5E)5(3ETHOXY4((4FLUOROBENZYL)OXY)5(PROP2EN1YL)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETICACID
2((5E)5((3ethoxy4((4fluorophenyl)methoxy)5prop2enylphenyl)methylidene)24dioxo13thiazolidin3yl)aceticacid
CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)F)CC=C)C=C3C(=O)N(C(=O)S3)CC(=O)O
CCOc1cc(C=C2SC(=O)N(C2=O)CC(=O)O)cc(c1OCc1ccc(cc1)F)CC=C
InChI=1SC24H22FNO6Sc135171016(122023(29)26(1321(27)28)24(30)3320)1119(3142)22(17)3214156818(25)9715h3612H1451314H22H3(H2728)b2012+
MFCD04128138
ZINC000009323698
ZINC9323698
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