Vitas-M small molecule compound

(5Z)-5-{2-[2-(3-methoxyphenoxy)ethoxy]-5-nitrobenzylidene}-3-methyl-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK065041
SMILES COc1cccc(c1)OCCOc1ccc(cc1/C=C/1\SC(=S)N(C1=O)C)[N+](=O)[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 C20H18N2O6S2 MW 446.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O6S2/c1-21-19(23)18(30-20(21)29)11-13-10-14(22(24)25)6-7-17(13)28-9-8-27-16-5-3-4-15(12-16)26-2/h3-7,10-12H,8-9H2,1-2H3/b18-11-
InChIKey
WWDFLMPDORZIQP-WQRHYEAKSA-N
Synonyms

(5Z)5((2(2(3METHOXYPHENOXY)ETHOXY)5NITROPHENYL)METHYLIDENE)3METHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(2(2(3METHOXYPHENOXY)ETHOXY)5NITROBENZYLIDENE)3METHYL2THIOXO13THIAZOLIDIN4ONE
CN1C(=O)C(=CC2=C(C=CC(=C2)(N+)(=O)(O))OCCOC3=CC=CC(=C3)OC)SC1=S
COc1cccc(c1)OCCOc1ccc(cc1C=C1SC(=S)N(C1=O)C)(N+)(=O)(O)
InChI=1SC20H18N2O6S2c12119(23)18(3020(21)29)11131014(22(24)25)6717(13)2898271653415(1216)262h371012H89H212H3b1811
MFCD03227698
STK065041
ZINC000009553821
ZINC09553821
ZINC9553821

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Available files

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