Vitas-M small molecule compound
(5Z)-5-{2-[2-(3-methylphenoxy)ethoxy]-5-nitrobenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK093717
SMILES S=C1NC(=O)/C(=C/c2cc(ccc2OCCOc2cccc(c2)C)[N+](=O)[O-])/S1
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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 C19H16N2O5S2 MW 416.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O5S2/c1-12-3-2-4-15(9-12)25-7-8-26-16-6-5-14(21(23)24)10-13(16)11-17-18(22)20-19(27)28-17/h2-6,9-11H,7-8H2,1H3,(H,20,22,27)/b17-11-InChIKey
HXXYQAGBNXKJJY-BOPFTXTBSA-NSynonyms
(5Z)5((2(2(3METHYLPHENOXY)ETHOXY)5NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(2(2(3METHYLPHENOXY)ETHOXY)5NITROBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CC1=CC(=CC=C1)OCCOC2=C(C=C(C=C2)(N+)(=O)(O))C=C3C(=O)NC(=S)S3
InChI=1SC19H16N2O5S2c11232415(912)257826166514(21(23)24)1013(16)111718(22)2019(27)2817h26911H78H21H3(H202227)b1711
MFCD03227762
S=C1NC(=O)C(=Cc2cc(ccc2OCCOc2cccc(c2)C)(N+)(=O)(O))S1
STK093717
ZINC000009730556
ZINC9730556
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