Vitas-M small molecule compound

4-({4-[(5E)-5-(4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid

Catalog ID
STL337192
SMILES COc1ccc(cc1)/C=C\1/SC(=O)N(C1=O)CCCC(=O)Nc1ccc(cc1)C(=O)O

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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 C22H20N2O6S MW 440.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O6S/c1-30-17-10-4-14(5-11-17)13-18-20(26)24(22(29)31-18)12-2-3-19(25)23-16-8-6-15(7-9-16)21(27)28/h4-11,13H,2-3,12H2,1H3,(H,23,25)(H,27,28)/b18-13+
InChIKey
XRHJFZNAPLHHLW-QGOAFFKASA-N
Synonyms
308295-16-1
(E)4(4(5(4methoxybenzylidene)24dioxothiazolidin3yl)butanamido)benzoicacid
308295161
4((4((5E)5(4methoxybenzylidene)24dioxo13thiazolidin3yl)butanoyl)amino)benzoicacid
4(4((5E)5((4METHOXYPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)BUTANOYLAMINO)BENZOICACID
4(4(5((4METHOXYPHENYL)METHYLENE)24DIOXO13THIAZOLIDIN3YL)BUTANOYLAMINO)BENZOICACID
COC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CCCC(=O)NC3=CC=C(C=C3)C(=O)O
COc1ccc(cc1)C=C1SC(=O)N(C1=O)CCCC(=O)Nc1ccc(cc1)C(=O)O
InChI=1SC22H20N2O6Sc1301710414(51117)131820(26)24(22(29)3118)122319(25)23168615(7916)21(27)28h41113H2312H21H3(H2325)(H2728)b1813+
MFCD03130743
ZINC000001185442
ZINC1185442

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Available files

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