Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[(5Z)-4-oxo-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-3-yl]acetamide
Catalog ID
STK994189
SMILES COc1cc(/C=C/2\SC(=S)N(C2=O)CC(=O)Nc2ccc3c(c2)OCO3)cc(c1OC)OC
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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 C22H20N2O7S2 MW 488.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O7S2/c1-27-16-6-12(7-17(28-2)20(16)29-3)8-18-21(26)24(22(32)33-18)10-19(25)23-13-4-5-14-15(9-13)31-11-30-14/h4-9H,10-11H2,1-3H3,(H,23,25)/b18-8-InChIKey
XOMCURVAPDYIIB-LSCVHKIXSA-NSynonyms
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)N(C(=S)S2)CC(=O)NC3=CC4=C(C=C3)OCO4
COc1cc(C=C2SC(=S)N(C2=O)CC(=O)Nc2ccc3c(c2)OCO3)cc(c1OC)OC
InChI=1SC22H20N2O7S2c12716612(717(282)20(16)293)81821(26)24(22(32)3318)1019(25)2313451415(913)31113014h49H1011H213H3(H2325)b188
MFCD02077945
N(13BENZODIOXOL5YL)2((5Z)4OXO2SULFANYLIDENE5((345TRIMETHOXYPHENYL)METHYLIDENE)13THIAZOLIDIN3YL)ACETAMIDE
N(13benzodioxol5yl)2((5Z)4oxo2thioxo5(345trimethoxybenzylidene)13thiazolidin3yl)acetamide
ZINC000016901429
ZINC16901429
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