Vitas-M small molecule compound
(5E)-3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[3-ethoxy-4-(propan-2-yloxy)benzylidene]-1,3-thiazolidine-2,4-dione
Catalog ID
STL379958
SMILES CCOc1cc(ccc1OC(C)C)/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 C23H22ClNO6S MW 475.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClNO6S/c1-4-28-18-7-14(5-6-17(18)31-13(2)3)8-21-22(26)25(23(27)32-21)11-15-9-19-20(10-16(15)24)30-12-29-19/h5-10,13H,4,11-12H2,1-3H3/b21-8+InChIKey
IXFMLHVBFMEPLR-ODCIPOBUSA-NSynonyms
(5E)3((6CHLORO13BENZODIOXOL5YL)METHYL)5((3ETHOXY4PROPAN2YLOXYPHENYL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5E)3((6chloro13benzodioxol5yl)methyl)5(3ethoxy4(propan2yloxy)benzylidene)13thiazolidine24dione
3((6CHLORO13BENZODIOXOL5YL)METHYL)5(3ETHOXY4ISOPROPOXYBENZYLIDENE)13THIAZOLIDINE24DIONE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC4=C(C=C3Cl)OCO4)OC(C)C
CCOc1cc(ccc1OC(C)C)C=C1SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl
InChI=1SC23H22ClNO6Sc142818714(5617(18)3113(2)3)82122(26)25(23(27)3221)111591920(1016(15)24)30122919h51013H41112H213H3b218+
MFCD03865294
ZINC000001013166
ZINC01013166
ZINC1013166
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