Vitas-M small molecule compound

4-[(5-bromo-4-{(Z)-[2,4-dioxo-3-(2-oxo-2-phenylethyl)-1,3-thiazolidin-5-ylidene]methyl}-2-ethoxyphenoxy)methyl]benzoic acid

Catalog ID
STL412256
SMILES CCOc1cc(/C=C/2\SC(=O)N(C2=O)CC(=O)c2ccccc2)c(cc1OCc1ccc(cc1)C(=O)O)Br

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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 C28H22BrNO7S MW 596.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22BrNO7S/c1-2-36-23-12-20(21(29)14-24(23)37-16-17-8-10-19(11-9-17)27(33)34)13-25-26(32)30(28(35)38-25)15-22(31)18-6-4-3-5-7-18/h3-14H,2,15-16H2,1H3,(H,33,34)/b25-13-
InChIKey
UZYMVECXXFVCGS-MXAYSNPKSA-N
Synonyms
497836-10-9
4((5BROMO4((24DIOXO3(2OXO2PHENYLETHYL)13THIAZOLIDIN5YLIDENE)METHYL)2ETHOXYPHENOXY)METHYL)BENZOICACID
4((5bromo4((Z)(24dioxo3(2oxo2phenylethyl)13thiazolidin5ylidene)methyl)2ethoxyphenoxy)methyl)benzoicacid
4((5BROMO4((Z)(24DIOXO3PHENACYL13THIAZOLIDIN5YLIDENE)METHYL)2ETHOXYPHENOXY)METHYL)BENZOICACID
4((5BROMO4((Z)(24DIOXO3PHENACYLTHIAZOLIDIN5YLIDENE)METHYL)2ETHOXYPHENOXY)METHYL)BENZOICACID
497836109
CCOC1=C(C=C(C(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)C3=CC=CC=C3)Br)OCC4=CC=C(C=C4)C(=O)O
CCOc1cc(C=C2SC(=O)N(C2=O)CC(=O)c2ccccc2)c(cc1OCc1ccc(cc1)C(=O)O)Br
InChI=1SC28H22BrNO7Sc1236231220(21(29)1424(23)37161781019(11917)27(33)34)132526(32)30(28(35)3825)1522(31)186435718h314H21516H21H3(H3334)b2513
MFCD03082603
ZINC000095575218
ZINC95575218

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Available files

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