Vitas-M small molecule compound
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-phenylpyrrolidine-2,3-dione
Catalog ID
STL051941
SMILES Clc1ccc2c(c1)sc(n2)N1C(c2ccccc2)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O
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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 C26H17ClN2O5S MW 504.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17ClN2O5S/c27-16-7-8-17-20(13-16)35-26(28-17)29-22(14-4-2-1-3-5-14)21(24(31)25(29)32)23(30)15-6-9-18-19(12-15)34-11-10-33-18/h1-9,12-13,22,30H,10-11H2/b23-21+InChIKey
OPNFMGPPXFAOOP-XTQSDGFTSA-NSynonyms
573941-85-2(4E)1(6chloro13benzothiazol2yl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5phenylpyrrolidine23dione
573941852
C1COC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)Cl)C6=CC=CC=C6)O
Clc1ccc2c(c1)sc(n2)N1C(c2ccccc2)C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C1=O
InChI=1SC26H17ClN2O5Sc2716781720(1316)3526(2817)2922(144213514)21(24(31)25(29)32)23(30)15691819(1215)3411103318h1912132230H1011H2b2321+
MFCD05724557
ZINC000102890005
ZINC000102890008
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