Vitas-M small molecule compound
ethyl {(5E)-5-[4-(butan-2-yloxy)-3-chlorobenzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetate
Catalog ID
STK059869
SMILES CCOC(=O)CN1C(=O)S/C(=C/c2ccc(c(c2)Cl)OC(CC)C)/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 C18H20ClNO5S MW 397.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO5S/c1-4-11(3)25-14-7-6-12(8-13(14)19)9-15-17(22)20(18(23)26-15)10-16(21)24-5-2/h6-9,11H,4-5,10H2,1-3H3/b15-9+InChIKey
ZMOUVVZHXLDFPK-OQLLNIDSSA-NSynonyms
CCC(C)OC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)OCC)Cl
CCOC(=O)CN1C(=O)SC(=Cc2ccc(c(c2)Cl)OC(CC)C)C1=O
ETHYL((5E)5(4(BUTAN2YLOXY)3CHLOROBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5E)5((4BUTAN2YLOXY3CHLOROPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC18H20ClNO5Sc1411(3)25147612(813(14)19)91517(22)20(18(23)2615)1016(21)2452h6911H4510H213H3b159+
MFCD03141779
STK059869
ZINC000001157771
ZINC000001157773
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