Vitas-M small molecule compound
2-(4-{(Z)-[3-(2-chloro-6-fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)-N-(2-methoxyphenyl)acetamide
Catalog ID
STL379969
SMILES COc1cc(ccc1OCC(=O)Nc1ccccc1OC)/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 C27H22ClFN2O6S MW 557.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClFN2O6S/c1-35-21-9-4-3-8-20(21)30-25(32)15-37-22-11-10-16(12-23(22)36-2)13-24-26(33)31(27(34)38-24)14-17-18(28)6-5-7-19(17)29/h3-13H,14-15H2,1-2H3,(H,30,32)/b24-13-InChIKey
KRSRHERAFMGAQL-CFRMEGHHSA-NSynonyms
2(4((Z)(3((2chloro6fluorophenyl)methyl)24dioxo13thiazolidin5ylidene)methyl)2methoxyphenoxy)N(2methoxyphenyl)acetamide
2(4((Z)(3(2chloro6fluorobenzyl)24dioxo13thiazolidin5ylidene)methyl)2methoxyphenoxy)N(2methoxyphenyl)acetamide
COC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2)C=C3C(=O)N(C(=O)S3)CC4=C(C=CC=C4Cl)F)OC
COc1cc(ccc1OCC(=O)Nc1ccccc1OC)C=C1SC(=O)N(C1=O)Cc1c(F)cccc1Cl
InChI=1SC27H22ClFN2O6Sc13521943820(21)3025(32)153722111016(1223(22)362)132426(33)31(27(34)3824)141718(28)65719(17)29h313H1415H212H3(H3032)b2413
MFCD28951044
ZINC000105980662
ZINC105980662
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