Vitas-M small molecule compound

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

Catalog ID
STK098402
SMILES COc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)c1ccccc1

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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 C24H18N2O5S2 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O5S2/c1-30-21-13-17(9-12-20(21)31-15-16-7-10-19(11-8-16)26(28)29)14-22-23(27)25(24(32)33-22)18-5-3-2-4-6-18/h2-14H,15H2,1H3/b22-14+
InChIKey
RCUVNHZFZGQOQA-HYARGMPZSA-N
Synonyms

(5E)5((3methoxy4((4nitrophenyl)methoxy)phenyl)methylidene)3phenyl2sulfanylidene13thiazolidin4one
(5E)5(3METHOXY4((4NITROBENZYL)OXY)BENZYLIDENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC=C3)OCC4=CC=C(C=C4)(N+)(=O)(O)
COc1cc(ccc1OCc1ccc(cc1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)c1ccccc1
InChI=1SC24H18N2O5S2c130211317(91220(21)31151671019(11816)26(28)29)142223(27)25(24(32)3322)185324618h214H15H21H3b2214+
MFCD00763557
STK098402
ZINC000003097611
ZINC03097611
ZINC3097611

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Available files

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