Vitas-M small molecule compound
dimethyl 2-{(5Z)-4-oxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-3-yl}butanedioate
Catalog ID
STK847394
SMILES COC(=O)C(N1C(=S)S/C(=C\C=C\c2ccccc2)/C1=O)CC(=O)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 C18H17NO5S2 MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO5S2/c1-23-15(20)11-13(17(22)24-2)19-16(21)14(26-18(19)25)10-6-9-12-7-4-3-5-8-12/h3-10,13H,11H2,1-2H3/b9-6+,14-10-InChIKey
XCLVUASGBWIIHX-NHZNEZGNSA-NSynonyms
COC(=O)C(N1C(=S)SC(=CC=Cc2ccccc2)C1=O)CC(=O)OC
COC(=O)CC(C(=O)OC)N1C(=O)C(=CC=CC2=CC=CC=C2)SC1=S
dimethyl2((5Z)4oxo5((2E)3phenylprop2en1ylidene)2thioxo13thiazolidin3yl)butanedioate
DIMETHYL2((5Z)4OXO5((E)3PHENYLPROP2ENYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANEDIOATE
dimethyl2((Z)4oxo5((E)3phenylallylidene)2thioxothiazolidin3yl)succinate
DIMETHYL2(5((2E)3PHENYLPROP2ENYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANE14DIOATE
InChI=1SC18H17NO5S2c12315(20)1113(17(22)242)1916(21)14(2618(19)25)1069127435812h31013H11H212H3b96+1410
MFCD02364795
ZINC000001773309
ZINC000004278711
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