Vitas-M small molecule compound
(4E)-5-(2-fluorophenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK567294
SMILES COc1cccc(c1)/C(=C\1/C(c2ccccc2F)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)C)/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 C26H19FN2O4S MW 474.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19FN2O4S/c1-14-10-11-19-20(12-14)34-26(28-19)29-22(17-8-3-4-9-18(17)27)21(24(31)25(29)32)23(30)15-6-5-7-16(13-15)33-2/h3-13,22,30H,1-2H3/b23-21+InChIKey
KIKBOOYTUSPPTQ-XTQSDGFTSA-NSynonyms
607686-57-7(4E)5(2fluorophenyl)4(hydroxy(3methoxyphenyl)methylidene)1(6methyl13benzothiazol2yl)pyrrolidine23dione
607686577
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC(=CC=C4)OC)O)C(=O)C3=O)C5=CC=CC=C5F
COc1cccc(c1)C(=C1C(c2ccccc2F)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)C)O
InChI=1SC26H19FN2O4Sc11410111920(1214)3426(2819)2922(17834918(17)27)21(24(31)25(29)32)23(30)1565716(1315)332h3132230H12H3b2321+
MFCD05731103
ZINC000102546744
ZINC000102546751
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