Vitas-M small molecule compound
(5Z)-5-{3-bromo-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK178583
SMILES C#CCN1C(=O)S/C(=C\c2cc(Br)c(c(c2)OC)OCc2ccc(cc2)F)/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 C21H15BrFNO4S MW 476.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrFNO4S/c1-3-8-24-20(25)18(29-21(24)26)11-14-9-16(22)19(17(10-14)27-2)28-12-13-4-6-15(23)7-5-13/h1,4-7,9-11H,8,12H2,2H3/b18-11-InChIKey
CCGMCVQQHRCSML-WQRHYEAKSA-NSynonyms
(5Z)5((3BROMO4((4FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)3PROP2YNYL13THIAZOLIDINE24DIONE
(5Z)5(3BROMO4((4FLUOROBENZYL)OXY)5METHOXYBENZYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
C#CCN1C(=O)SC(=Cc2cc(Br)c(c(c2)OC)OCc2ccc(cc2)F)C1=O
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC#C)Br)OCC3=CC=C(C=C3)F
InChI=1SC21H15BrFNO4Sc1382420(25)18(2921(24)26)1114916(22)19(17(1014)272)2812134615(23)7513h147911H812H22H3b1811
MFCD06663895
ZINC000013939712
ZINC13939712
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