Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-[3-methoxy-4-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STL051659
SMILES CCCCCOc1ccc(cc1OC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)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 C34H34N2O7S MW 614.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34N2O7S/c1-5-6-7-12-41-23-10-8-21(17-25(23)40-4)30-28(31(37)22-9-11-24-26(18-22)43-14-13-42-24)32(38)33(39)36(30)34-35-29-20(3)15-19(2)16-27(29)44-34/h8-11,15-18,30,37H,5-7,12-14H2,1-4H3/b31-28+InChIKey
FYJDJTKGBZYCRM-CCFHIKDMSA-NSynonyms
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(46dimethyl13benzothiazol2yl)5(3methoxy4(pentyloxy)phenyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(46DIMETHYL13BENZOTHIAZOL2YL)5(3METHOXY4PENTOXYPHENYL)PYRROLIDINE23DIONE
CCCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NC6=C(C=C(C=C6S5)C)C)OC
CCCCCOc1ccc(cc1OC)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
InChI=1SC34H34N2O7Sc156712412310821(1725(23)404)3028(31(37)229112426(1822)4314134224)32(38)33(39)36(30)34352920(3)1519(2)1627(29)4434h81115183037H571214H214H3b3128+
MFCD05733544
ZINC000102888924
ZINC000102888926
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.