Vitas-M small molecule compound
methyl 3-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Catalog ID
STK835752
SMILES COC(=O)CCN1C(=S)S/C(=C/c2ccc3c(c2)OCO3)/C1=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 C15H13NO5S2 MW 351.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO5S2/c1-19-13(17)4-5-16-14(18)12(23-15(16)22)7-9-2-3-10-11(6-9)21-8-20-10/h2-3,6-7H,4-5,8H2,1H3/b12-7+InChIKey
XIFCQCVLPAEKCI-KPKJPENVSA-NSynonyms
300812-74-2(E)methyl3(5(benzo(d)(13)dioxol5ylmethylene)4oxo2thioxothiazolidin3yl)propanoate
300812742
COC(=O)CCN1C(=O)C(=CC2=CC3=C(C=C2)OCO3)SC1=S
COC(=O)CCN1C(=S)SC(=Cc2ccc3c(c2)OCO3)C1=O
InChI=1SC15H13NO5S2c11913(17)451614(18)12(2315(16)22)79231011(69)2182010h2367H458H21H3b127+
METHYL3((5E)5(13BENZODIOXOL5YLMETHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOATE
methyl3((5E)5(13benzodioxol5ylmethylidene)4oxo2thioxo13thiazolidin3yl)propanoate
MFCD01943506
ZINC000004844288
ZINC04844288
ZINC4844288
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