Vitas-M small molecule compound
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL054882
SMILES C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)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 C32H27ClN2O6S MW 603.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27ClN2O6S/c1-4-12-40-24-11-6-18(15-25(24)39-5-2)28-27(29(36)19-7-10-23-20(14-19)13-17(3)41-23)30(37)31(38)35(28)32-34-22-9-8-21(33)16-26(22)42-32/h4,6-11,14-17,28,36H,1,5,12-13H2,2-3H3/b29-27+InChIKey
UAKRJNWZHAOXPN-ORIPQNMZSA-NSynonyms
893702-12-0(4E)1(6chloro13benzothiazol2yl)5(3ethoxy4(prop2en1yloxy)phenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
(4E)1(6CHLORO13BENZOTHIAZOL2YL)5(3ETHOXY4PROP2ENOXYPHENYL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)PYRROLIDINE23DIONE
893702120
C=CCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)Cl)OCC=C
InChI=1SC32H27ClN2O6Sc1412402411618(1525(24)3952)2827(29(36)197102320(1419)1317(3)4123)30(37)31(38)35(28)3234229821(33)1626(22)4232h461114172836H151213H223H3b2927+
MFCD05725283
ZINC000101310263
ZINC000101310272
Check stock
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