Vitas-M small molecule compound
4-[(2-{(E)-[3-(2-chloro-6-fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)methyl]benzoic acid
Catalog ID
STK157616
SMILES OC(=O)c1ccc(cc1)COc1ccccc1/C=C\1/SC(=O)N(C1=O)Cc1c(F)cccc1Cl
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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 C25H17ClFNO5S MW 497.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClFNO5S/c26-19-5-3-6-20(27)18(19)13-28-23(29)22(34-25(28)32)12-17-4-1-2-7-21(17)33-14-15-8-10-16(11-9-15)24(30)31/h1-12H,13-14H2,(H,30,31)/b22-12+InChIKey
KOABTJVTKJNNTP-WSDLNYQXSA-NSynonyms
4((2((E)(3((2chloro6fluorophenyl)methyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)methyl)benzoicacid
4((2((E)(3(2CHLORO6FLUOROBENZYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
C1=CC=C(C(=C1)C=C2C(=O)N(C(=O)S2)CC3=C(C=CC=C3Cl)F)OCC4=CC=C(C=C4)C(=O)O
InChI=1SC25H17ClFNO5Sc261953620(27)18(19)132823(29)22(3425(28)32)1217412721(17)33141581016(11915)24(30)31h112H1314H2(H3031)b2212+
MFCD04544407
OC(=O)c1ccc(cc1)COc1ccccc1C=C1SC(=O)N(C1=O)Cc1c(F)cccc1Cl
ZINC000009261218
ZINC9261218
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