Vitas-M small molecule compound
3-[(5Z)-5-{3-ethoxy-4-[(2-fluorobenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoic acid
Catalog ID
STK002844
SMILES CCOc1cc(ccc1OCc1ccccc1F)/C=C/1\SC(=S)N(C1=O)c1cccc(c1)C(=O)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 C26H20FNO5S2 MW 509.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20FNO5S2/c1-2-32-22-12-16(10-11-21(22)33-15-18-6-3-4-9-20(18)27)13-23-24(29)28(26(34)35-23)19-8-5-7-17(14-19)25(30)31/h3-14H,2,15H2,1H3,(H,30,31)/b23-13-InChIKey
ZICMOKRBZHCPDH-QRVIBDJDSA-NSynonyms
3((5Z)5((3ETHOXY4((2FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOICACID
3((5Z)5(3ETHOXY4((2FLUOROBENZYL)OXY)BENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BENZOICACID
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)O)OCC4=CC=CC=C4F
CCOc1cc(ccc1OCc1ccccc1F)C=C1SC(=S)N(C1=O)c1cccc(c1)C(=O)O
InChI=1SC26H20FNO5S2c1232221216(101121(22)331518634920(18)27)132324(29)28(26(34)3523)1985717(1419)25(30)31h314H215H21H3(H3031)b2313
MFCD08049072
STK002844
ZINC000009957302
ZINC9957302
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