Vitas-M small molecule compound

(5Z)-5-{4-[(2-chlorobenzyl)oxy]benzylidene}-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione

Catalog ID
STK157160
SMILES O=C1S/C(=C\c2ccc(cc2)OCc2ccccc2Cl)/C(=O)N1Cc1cccc(c1)[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 C24H17ClN2O5S MW 480.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClN2O5S/c25-21-7-2-1-5-18(21)15-32-20-10-8-16(9-11-20)13-22-23(28)26(24(29)33-22)14-17-4-3-6-19(12-17)27(30)31/h1-13H,14-15H2/b22-13-
InChIKey
NYYHHOOJOODDCY-XKZIYDEJSA-N
Synonyms

(5Z)5((4((2CHLOROPHENYL)METHOXY)PHENYL)METHYLIDENE)3((3NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5Z)5(4((2CHLOROBENZYL)OXY)BENZYLIDENE)3(3NITROBENZYL)13THIAZOLIDINE24DIONE
C1=CC=C(C(=C1)COC2=CC=C(C=C2)C=C3C(=O)N(C(=O)S3)CC4=CC(=CC=C4)(N+)(=O)(O))Cl
InChI=1SC24H17ClN2O5Sc2521721518(21)15322010816(91120)132223(28)26(24(29)3322)141743619(1217)27(30)31h113H1415H2b2213
MFCD03226926
O=C1SC(=Cc2ccc(cc2)OCc2ccccc2Cl)C(=O)N1Cc1cccc(c1)(N+)(=O)(O)
ZINC000009720886
ZINC09720886
ZINC9720886

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Available files

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