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-phenylpyrrolidine-2,3-dione
Catalog ID
STK567846
SMILES COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccccc1
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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 C27H20N2O6S MW 500.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N2O6S/c1-33-17-8-9-18-21(14-17)36-27(28-18)29-23(15-5-3-2-4-6-15)22(25(31)26(29)32)24(30)16-7-10-19-20(13-16)35-12-11-34-19/h2-10,13-14,23,30H,11-12H2,1H3/b24-22+InChIKey
TVUIKRWTXCMPJS-ZNTNEXAZSA-NSynonyms
573938-73-5(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(6methoxy13benzothiazol2yl)5phenylpyrrolidine23dione
573938735
COC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC5=C(C=C4)OCCO5)O)C(=O)C3=O)C6=CC=CC=C6
COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C1c1ccccc1
InChI=1SC27H20N2O6Sc13317891821(1417)3627(2818)2923(155324615)22(25(31)26(29)32)24(30)167101920(1316)3512113419h21013142330H1112H21H3b2422+
MFCD07210320
ZINC000102652073
ZINC000102652074
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