Vitas-M small molecule compound

(5Z)-3-benzyl-5-{3-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STL372046
SMILES COc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=C/1\SC(=S)N(C1=O)Cc1ccccc1

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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 C25H20N2O5S2 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O5S2/c1-31-22-13-19(9-12-21(22)32-16-18-7-10-20(11-8-18)27(29)30)14-23-24(28)26(25(33)34-23)15-17-5-3-2-4-6-17/h2-14H,15-16H2,1H3/b23-14-
InChIKey
BDXPZDRKJKGWCK-UCQKPKSFSA-N
Synonyms

(5Z)3BENZYL5((3METHOXY4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3benzyl5(3methoxy4((4nitrobenzyl)oxy)benzylidene)2thioxo13thiazolidin4one
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)OCC4=CC=C(C=C4)(N+)(=O)(O)
COc1cc(ccc1OCc1ccc(cc1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC25H20N2O5S2c131221319(91221(22)32161871020(11818)27(29)30)142324(28)26(25(33)3423)15175324617h214H1516H21H3b2314
MFCD03710057
ZINC000016193257
ZINC16193257

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Available files

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