Vitas-M small molecule compound
{4-[(E)-(3-{2-[(2-chlorophenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenoxy}acetic acid
Catalog ID
STK219530
SMILES COc1cc(ccc1OCC(=O)O)/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccccc1Cl
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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 C21H17ClN2O7S MW 476.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O7S/c1-30-16-8-12(6-7-15(16)31-11-19(26)27)9-17-20(28)24(21(29)32-17)10-18(25)23-14-5-3-2-4-13(14)22/h2-9H,10-11H2,1H3,(H,23,25)(H,26,27)/b17-9+InChIKey
WYLGXOHIDMWHIT-RQZCQDPDSA-NSynonyms
(4((E)(3(2((2CHLOROPHENYL)AMINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENOXY)ACETICACID
2(4((E)(3(2(2chloroanilino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)2methoxyphenoxy)aceticacid
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC=CC=C3Cl)OCC(=O)O
COc1cc(ccc1OCC(=O)O)C=C1SC(=O)N(C1=O)CC(=O)Nc1ccccc1Cl
InChI=1SC21H17ClN2O7Sc13016812(6715(16)311119(26)27)91720(28)24(21(29)3217)1018(25)2314532413(14)22h29H1011H21H3(H2325)(H2627)b179+
MFCD07115383
ZINC000010059756
ZINC10059756
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