Vitas-M small molecule compound

(5Z)-3-benzyl-5-{2-[(2-methylbenzyl)oxy]-5-nitrobenzylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK074019
SMILES S=C1S/C(=C\c2cc(ccc2OCc2ccccc2C)[N+](=O)[O-])/C(=O)N1Cc1ccccc1

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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 C25H20N2O4S2 MW 476.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O4S2/c1-17-7-5-6-10-19(17)16-31-22-12-11-21(27(29)30)13-20(22)14-23-24(28)26(25(32)33-23)15-18-8-3-2-4-9-18/h2-14H,15-16H2,1H3/b23-14-
InChIKey
HVOHTQMKGGRJOR-UCQKPKSFSA-N
Synonyms

(5Z)3BENZYL5((2((2METHYLPHENYL)METHOXY)5NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3BENZYL5(2((2METHYLBENZYL)OXY)5NITROBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CC1=CC=CC=C1COC2=C(C=C(C=C2)(N+)(=O)(O))C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4
InChI=1SC25H20N2O4S2c1177561019(17)163122121121(27(29)30)1320(22)142324(28)26(25(32)3323)15188324918h214H1516H21H3b2314
MFCD03228086
S=C1SC(=Cc2cc(ccc2OCc2ccccc2C)(N+)(=O)(O))C(=O)N1Cc1ccccc1
STK074019
ZINC000013899098
ZINC13899098

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Available files

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