Vitas-M small molecule compound
2-(2-{(E)-[3-(cyclohexylmethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-6-methoxyphenoxy)-N-(4-methylphenyl)acetamide
Catalog ID
STK117783
SMILES COc1cccc(c1OCC(=O)Nc1ccc(cc1)C)/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 C27H30N2O5S MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O5S/c1-18-11-13-21(14-12-18)28-24(30)17-34-25-20(9-6-10-22(25)33-2)15-23-26(31)29(27(32)35-23)16-19-7-4-3-5-8-19/h6,9-15,19H,3-5,7-8,16-17H2,1-2H3,(H,28,30)/b23-15+InChIKey
QCWHMSRSVALQJY-HZHRSRAPSA-NSynonyms
2(2((E)(3(CYCLOHEXYLMETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)6METHOXYPHENOXY)N(4METHYLPHENYL)ACETAMIDE
CC1=CC=C(C=C1)NC(=O)COC2=C(C=CC=C2OC)C=C3C(=O)N(C(=O)S3)CC4CCCCC4
COc1cccc(c1OCC(=O)Nc1ccc(cc1)C)C=C1SC(=O)N(C1=O)CC1CCCCC1
InChI=1SC27H30N2O5Sc118111321(141218)2824(30)17342520(961022(25)332)152326(31)29(27(32)3523)16197435819h691519H35781617H212H3(H2830)b2315+
MFCD04128071
ZINC000009323575
ZINC09323575
ZINC9323575
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