Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{(5Z)-2,4-dioxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-1,3-thiazolidin-3-yl}acetamide
Catalog ID
STK119807
SMILES O=C(CN1C(=O)S/C(=C\C=C\c2ccccc2)/C1=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 C21H16N2O5S MW 408.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O5S/c24-19(22-15-9-10-16-17(11-15)28-13-27-16)12-23-20(25)18(29-21(23)26)8-4-7-14-5-2-1-3-6-14/h1-11H,12-13H2,(H,22,24)/b7-4+,18-8-InChIKey
STKWOOXMVYTCQL-DFBITEFZSA-NSynonyms
C1OC2=C(O1)C=C(C=C2)NC(=O)CN3C(=O)C(=CC=CC4=CC=CC=C4)SC3=O
InChI=1SC21H16N2O5Sc2419(22159101617(1115)28132716)122320(25)18(2921(23)26)847145213614h111H1213H2(H2224)b74+188
MFCD04128925
N(13BENZODIOXOL5YL)2((5Z)24DIOXO5((2E)3PHENYLPROP2EN1YLIDENE)13THIAZOLIDIN3YL)ACETAMIDE
N(13BENZODIOXOL5YL)2((5Z)24DIOXO5((E)3PHENYLPROP2ENYLIDENE)13THIAZOLIDIN3YL)ACETAMIDE
O=C(CN1C(=O)SC(=CC=Cc2ccccc2)C1=O)Nc1ccc2c(c1)OCO2
ZINC000004691501
ZINC04691501
ZINC4691501
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