Vitas-M small molecule compound
(5E)-5-{3-chloro-4-[3-(3,5-dimethylphenoxy)propoxy]-5-methoxybenzylidene}-3-phenyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK085279
SMILES COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccccc2)cc(c1OCCCOc1cc(C)cc(c1)C)Cl
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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 C28H26ClNO4S2 MW 540.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClNO4S2/c1-18-12-19(2)14-22(13-18)33-10-7-11-34-26-23(29)15-20(16-24(26)32-3)17-25-27(31)30(28(35)36-25)21-8-5-4-6-9-21/h4-6,8-9,12-17H,7,10-11H2,1-3H3/b25-17+InChIKey
YNFWDUHMRUALAD-KOEQRZSOSA-NSynonyms
(5E)5((3chloro4(3(35dimethylphenoxy)propoxy)5methoxyphenyl)methylidene)3phenyl2sulfanylidene13thiazolidin4one
(5E)5(3CHLORO4(3(35DIMETHYLPHENOXY)PROPOXY)5METHOXYBENZYLIDENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
CC1=CC(=CC(=C1)OCCCOC2=C(C=C(C=C2Cl)C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4)OC)C
COc1cc(C=C2SC(=S)N(C2=O)c2ccccc2)cc(c1OCCCOc1cc(C)cc(c1)C)Cl
InChI=1SC28H26ClNO4S2c1181219(2)1422(1318)3310711342623(29)1520(1624(26)323)172527(31)30(28(35)3625)218546921h46891217H71011H213H3b2517+
MFCD08672794
STK085279
ZINC000097959126
ZINC97959126
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