Vitas-M small molecule compound
4-{(5E)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid
Catalog ID
STL231787
SMILES C/C(=C\c1ccccc1)/C=C\1/SC(=O)N(C1=O)CCCC(=O)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 C17H17NO4S MW 331.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO4S/c1-12(10-13-6-3-2-4-7-13)11-14-16(21)18(17(22)23-14)9-5-8-15(19)20/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,19,20)/b12-10+,14-11+InChIKey
GYNBIQYSIWHSCB-NCPBJGSTSA-NSynonyms
4((5E)5((2E)2methyl3phenylprop2en1ylidene)24dioxo13thiazolidin3yl)butanoicacid
4((5E)5((E)2METHYL3PHENYLPROP2ENYLIDENE)24DIOXO13THIAZOLIDIN3YL)BUTANOICACID
4((Z)5((E)2methyl3phenylallylidene)24dioxothiazolidin3yl)butanoicacid
CC(=CC1=CC=CC=C1)C=C2C(=O)N(C(=O)S2)CCCC(=O)O
CC(=Cc1ccccc1)C=C1SC(=O)N(C1=O)CCCC(=O)O
InChI=1SC17H17NO4Sc112(10136324713)111416(21)18(17(22)2314)95815(19)20h24671011H589H21H3(H1920)b1210+1411+
MFCD24858113
ZINC000027229267
ZINC27229267
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