Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STK568193
SMILES CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
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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 C32H30N2O6S MW 570.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O6S/c1-3-4-5-13-38-22-8-6-7-20(17-22)28-27(29(35)21-10-12-24-25(18-21)40-15-14-39-24)30(36)31(37)34(28)32-33-23-11-9-19(2)16-26(23)41-32/h6-12,16-18,28,35H,3-5,13-15H2,1-2H3/b29-27+InChIKey
UFNUIJGCQJZVHC-ORIPQNMZSA-NSynonyms
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(6methyl13benzothiazol2yl)5(3(pentyloxy)phenyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(6METHYL13BENZOTHIAZOL2YL)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)C
CCCCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
InChI=1SC32H30N2O6Sc134513382286720(1722)2827(29(35)2110122425(1821)4015143924)30(36)31(37)34(28)32332311919(2)1626(23)4132h61216182835H351315H212H3b2927+
MFCD05729462
ZINC000102652417
ZINC000102652422
Check stock
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Check stock on Vitas-MAvailable files
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