Vitas-M small molecule compound
4-[(4-{(E)-[3-(cyclohexylmethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)methyl]benzoic acid
Catalog ID
STK113566
SMILES COc1cc(ccc1OCc1ccc(cc1)C(=O)O)/C=C\1/SC(=O)N(C1=O)CC1CCCCC1
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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 C26H27NO6S MW 481.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO6S/c1-32-22-13-19(9-12-21(22)33-16-18-7-10-20(11-8-18)25(29)30)14-23-24(28)27(26(31)34-23)15-17-5-3-2-4-6-17/h7-14,17H,2-6,15-16H2,1H3,(H,29,30)/b23-14+InChIKey
NEZOFHZVDBCJDU-OEAKJJBVSA-NSynonyms
4((4((E)(3(CYCLOHEXYLMETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENOXY)METHYL)BENZOICACID
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3CCCCC3)OCC4=CC=C(C=C4)C(=O)O
COc1cc(ccc1OCc1ccc(cc1)C(=O)O)C=C1SC(=O)N(C1=O)CC1CCCCC1
InChI=1SC26H27NO6Sc132221319(91221(22)33161871020(11818)25(29)30)142324(28)27(26(31)3423)15175324617h71417H261516H21H3(H2930)b2314+
MFCD04127352
ZINC000009323297
ZINC9323297
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