Vitas-M small molecule compound

(5E)-5-(2-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}-5-nitrobenzylidene)-3-phenyl-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK380380
SMILES Cc1ccc(c(c1)OCCOc1ccc(cc1/C=C\1/SC(=S)N(C1=O)c1ccccc1)[N+](=O)[O-])C(C)C

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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 C28H26N2O5S2 MW 534.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O5S2/c1-18(2)23-11-9-19(3)15-25(23)35-14-13-34-24-12-10-22(30(32)33)16-20(24)17-26-27(31)29(28(36)37-26)21-7-5-4-6-8-21/h4-12,15-18H,13-14H2,1-3H3/b26-17+
InChIKey
ZTJRFVDLKSRNPL-YZSQISJMSA-N
Synonyms

(5E)5((2(2(5methyl2propan2ylphenoxy)ethoxy)5nitrophenyl)methylidene)3phenyl2sulfanylidene13thiazolidin4one
(5E)5(2(2(5methyl2(propan2yl)phenoxy)ethoxy)5nitrobenzylidene)3phenyl2thioxo13thiazolidin4one
5((2(2(5METHYL2(METHYLETHYL)PHENOXY)ETHOXY)5NITROPHENYL)METHYLENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)(N+)(=O)(O))C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4
Cc1ccc(c(c1)OCCOc1ccc(cc1C=C1SC(=S)N(C1=O)c1ccccc1)(N+)(=O)(O))C(C)C
InChI=1SC28H26N2O5S2c118(2)2311919(3)1525(23)3514133424121022(30(32)33)1620(24)172627(31)29(28(36)3726)217546821h4121518H1314H213H3b2617+
MFCD02122316
ZINC000059222104
ZINC59222104

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Available files

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