Vitas-M small molecule compound

(5Z)-5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4-hydroxy-1,3-thiazol-2(5H)-one

Catalog ID
STK631289
SMILES O=C1N=C(/C(=C/c2cc(n(c2C)c2ccc(c(c2)C)C)C)/S1)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 C18H18N2O2S MW 326.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O2S/c1-10-5-6-15(7-11(10)2)20-12(3)8-14(13(20)4)9-16-17(21)19-18(22)23-16/h5-9H,1-4H3,(H,19,21,22)/b16-9-
InChIKey
LBILVRNXTYBUGB-SXGWCWSVSA-N
Synonyms

(5Z)5((1(34dimethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)4hydroxy13thiazol2(5H)one
(5Z)5((1(34DIMETHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)13THIAZOLIDINE24DIONE
InChI=1SC18H18N2O2Sc1105615(711(10)2)2012(3)814(13(20)4)91617(21)1918(22)2316h59H14H3(H192122)b169
MFCD09792019
O=C1N=C(C(=Cc2cc(n(c2C)c2ccc(c(c2)C)C)C)S1)O
ZINC000015218825
ZINC15218825

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.