Vitas-M small molecule compound
(5E)-5-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK026460
SMILES O=C1S/C(=C/c2cc3OCOc3cc2Cl)/C(=O)N1Cc1cccc(c1)[N+](=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 C18H11ClN2O6S MW 418.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11ClN2O6S/c19-13-7-15-14(26-9-27-15)5-11(13)6-16-17(22)20(18(23)28-16)8-10-2-1-3-12(4-10)21(24)25/h1-7H,8-9H2/b16-6+InChIKey
FYRINRZUCIPVDP-OMCISZLKSA-NSynonyms
(5E)5((6CHLORO13BENZODIOXOL5YL)METHYLIDENE)3((3NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5E)5((6CHLORO13BENZODIOXOL5YL)METHYLIDENE)3(3NITROBENZYL)13THIAZOLIDINE24DIONE
C1OC2=C(O1)C=C(C(=C2)C=C3C(=O)N(C(=O)S3)CC4=CC(=CC=C4)(N+)(=O)(O))Cl
InChI=1SC18H11ClN2O6Sc191371514(2692715)511(13)61617(22)20(18(23)2816)81021312(410)21(24)25h17H89H2b166+
MFCD03141204
O=C1SC(=Cc2cc3OCOc3cc2Cl)C(=O)N1Cc1cccc(c1)(N+)(=O)(O)
STK026460
ZINC000013940650
ZINC13940650
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