Vitas-M small molecule compound
(5E)-5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK082687
SMILES [O-][N+](=O)c1cc(c2ccc(o2)/C=C\2/SC(=O)N(C2=O)CC#C)c(cc1)Cl
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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 C17H9ClN2O5S MW 388.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9ClN2O5S/c1-2-7-19-16(21)15(26-17(19)22)9-11-4-6-14(25-11)12-8-10(20(23)24)3-5-13(12)18/h1,3-6,8-9H,7H2/b15-9+InChIKey
DLPNNFCUBFGKEH-OQLLNIDSSA-NSynonyms
(5E)5((5(2CHLORO5NITROPHENYL)FURAN2YL)METHYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
(5E)5((5(2CHLORO5NITROPHENYL)FURAN2YL)METHYLIDENE)3PROP2YNYL13THIAZOLIDINE24DIONE
(O)(N+)(=O)c1cc(c2ccc(o2)C=C2SC(=O)N(C2=O)CC#C)c(cc1)Cl
C#CCN1C(=O)C(=CC2=CC=C(O2)C3=C(C=CC(=C3)(N+)(=O)(O))Cl)SC1=O
InChI=1SC17H9ClN2O5Sc1271916(21)15(2617(19)22)9114614(2511)12810(20(23)24)3513(12)18h13689H7H2b159+
MFCD03142215
STK082687
ZINC000012342683
ZINC12342683
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