Vitas-M small molecule compound
(4E)-5-[4-(benzyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK569809
SMILES CCOc1cc(ccc1OCc1ccccc1)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 C36H30N2O8S MW 650.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30N2O8S/c1-3-43-28-17-22(9-13-27(28)46-20-21-7-5-4-6-8-21)32-31(33(39)23-10-14-26-29(18-23)45-16-15-44-26)34(40)35(41)38(32)36-37-25-12-11-24(42-2)19-30(25)47-36/h4-14,17-19,32,39H,3,15-16,20H2,1-2H3/b33-31+InChIKey
WILFOJKZRHUJRB-QOSDPKFLSA-NSynonyms
618857-20-8(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(3ETHOXY4PHENYLMETHOXYPHENYL)1(6METHOXY13BENZOTHIAZOL2YL)PYRROLIDINE23DIONE
(4E)5(4(benzyloxy)3ethoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(6methoxy13benzothiazol2yl)pyrrolidine23dione
618857208
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)OC)OCC7=CC=CC=C7
CCOc1cc(ccc1OCc1ccccc1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC
InChI=1SC36H30N2O8Sc1343281722(91327(28)4620217546821)3231(33(39)2310142629(1823)4516154426)34(40)35(41)38(32)363725121124(422)1930(25)4736h41417193239H3151620H212H3b3331+
MFCD07206793
ZINC000150435833
ZINC000150435836
Check stock
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Check stock on Vitas-MAvailable files
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