Vitas-M small molecule compound
{2-chloro-4-[(Z)-{3-[2-(4-methylphenoxy)ethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}acetic acid
Catalog ID
STL358477
SMILES OC(=O)COc1ccc(cc1Cl)/C=C/1\SC(=O)N(C1=O)CCOc1ccc(cc1)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 C21H18ClNO6S MW 447.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClNO6S/c1-13-2-5-15(6-3-13)28-9-8-23-20(26)18(30-21(23)27)11-14-4-7-17(16(22)10-14)29-12-19(24)25/h2-7,10-11H,8-9,12H2,1H3,(H,24,25)/b18-11-InChIKey
LOJPXWSXDPFRSZ-WQRHYEAKSA-NSynonyms
(2chloro4((Z)(3(2(4methylphenoxy)ethyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)aceticacid
2(2CHLORO4((Z)(3(2(4METHYLPHENOXY)ETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETICACID
CC1=CC=C(C=C1)OCCN2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)O)Cl)SC2=O
InChI=1SC21H18ClNO6Sc1132515(6313)28982320(26)18(3021(23)27)11144717(16(22)1014)291219(24)25h271011H8912H21H3(H2425)b1811
MFCD03716477
OC(=O)COc1ccc(cc1Cl)C=C1SC(=O)N(C1=O)CCOc1ccc(cc1)C
ZINC000009296076
ZINC9296076
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