Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[(5E)-5-(4-ethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Catalog ID
STL035873
SMILES CCOc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CC(=O)Nc1ccc2c(c1)OCO2
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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 C21H18N2O5S2 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O5S2/c1-2-26-15-6-3-13(4-7-15)9-18-20(25)23(21(29)30-18)11-19(24)22-14-5-8-16-17(10-14)28-12-27-16/h3-10H,2,11-12H2,1H3,(H,22,24)/b18-9+InChIKey
YMIUQQRJQSNOEW-GIJQJNRQSA-NSynonyms
CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)NC3=CC4=C(C=C3)OCO4
CCOc1ccc(cc1)C=C1SC(=S)N(C1=O)CC(=O)Nc1ccc2c(c1)OCO2
InChI=1SC21H18N2O5S2c1226156313(4715)91820(25)23(21(29)3018)1119(24)2214581617(1014)28122716h310H21112H21H3(H2224)b189+
MFCD18192207
N(13benzodioxol5yl)2((5E)5((4ethoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)acetamide
N(13benzodioxol5yl)2((5E)5(4ethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetamide
ZINC000027530539
ZINC27530539
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