Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STL054333
SMILES CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC
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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 C32H30N2O7S MW 586.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O7S/c1-3-4-5-13-39-22-8-6-7-19(16-22)28-27(29(35)20-9-12-24-25(17-20)41-15-14-40-24)30(36)31(37)34(28)32-33-23-11-10-21(38-2)18-26(23)42-32/h6-12,16-18,28,35H,3-5,13-15H2,1-2H3/b29-27+InChIKey
YUCYMIYCGJHQTR-ORIPQNMZSA-NSynonyms
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(6methoxy13benzothiazol2yl)5(3(pentyloxy)phenyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(6METHOXY13BENZOTHIAZOL2YL)5(3PENTOXYPHENYL)PYRROLIDINE23DIONE
CCCCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)OC
CCCCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC
InChI=1SC32H30N2O7Sc134513392286719(1622)2827(29(35)209122425(1720)4115144024)30(36)31(37)34(28)323323111021(382)1826(23)4232h61216182835H351315H212H3b2927+
MFCD07210980
ZINC000102893710
ZINC000102893712
Check stock
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Check stock on Vitas-MAvailable files
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