Vitas-M small molecule compound
(5E)-3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-{[5-(4-chloro-2-fluorophenyl)furan-2-yl]methylidene}-1,3-thiazolidine-2,4-dione
Catalog ID
STL378891
SMILES Clc1ccc(c(c1)F)c1ccc(o1)/C=C\1/SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl
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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 C22H12Cl2FNO5S MW 492.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12Cl2FNO5S/c23-12-1-3-14(16(25)6-12)17-4-2-13(31-17)7-20-21(27)26(22(28)32-20)9-11-5-18-19(8-15(11)24)30-10-29-18/h1-8H,9-10H2/b20-7+InChIKey
BEFPJBYPYFLHQU-IFRROFPPSA-NSynonyms
(5E)3((6chloro13benzodioxol5yl)methyl)5((5(4chloro2fluorophenyl)furan2yl)methylidene)13thiazolidine24dione
C1OC2=C(O1)C=C(C(=C2)CN3C(=O)C(=CC4=CC=C(O4)C5=C(C=C(C=C5)Cl)F)SC3=O)Cl
Clc1ccc(c(c1)F)c1ccc(o1)C=C1SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl
InChI=1SC22H12Cl2FNO5Sc23121314(16(25)612)174213(3117)72021(27)26(22(28)3220)91151819(815(11)24)30102918h18H910H2b207+
MFCD03614472
ZINC000001411655
ZINC01411655
ZINC1411655
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