Vitas-M small molecule compound
(5E)-3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-1,3-thiazolidine-2,4-dione
Catalog ID
STL378972
SMILES O=C1S/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)Cl)/C(=O)N1Cc1cc2OCOc2cc1Cl
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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 C22H12Cl3NO5S MW 508.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12Cl3NO5S/c23-14-3-1-11(5-16(14)25)17-4-2-13(31-17)7-20-21(27)26(22(28)32-20)9-12-6-18-19(8-15(12)24)30-10-29-18/h1-8H,9-10H2/b20-7+InChIKey
VGFAWIZUIGCILB-IFRROFPPSA-NSynonyms
(5E)3((6chloro13benzodioxol5yl)methyl)5((5(34dichlorophenyl)furan2yl)methylidene)13thiazolidine24dione
C1OC2=C(O1)C=C(C(=C2)CN3C(=O)C(=CC4=CC=C(O4)C5=CC(=C(C=C5)Cl)Cl)SC3=O)Cl
InChI=1SC22H12Cl3NO5Sc23143111(516(14)25)174213(3117)72021(27)26(22(28)3220)91261819(815(12)24)30102918h18H910H2b207+
MFCD03614644
O=C1SC(=Cc2ccc(o2)c2ccc(c(c2)Cl)Cl)C(=O)N1Cc1cc2OCOc2cc1Cl
ZINC000003764445
ZINC03764445
ZINC3764445
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