Vitas-M small molecule compound
(5Z)-5-{3-[3-(4-tert-butylphenoxy)propoxy]benzylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK019540
SMILES CCN1C(=S)S/C(=C\c2cccc(c2)OCCCOc2ccc(cc2)C(C)(C)C)/C1=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 C25H29NO3S2 MW 455.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO3S2/c1-5-26-23(27)22(31-24(26)30)17-18-8-6-9-21(16-18)29-15-7-14-28-20-12-10-19(11-13-20)25(2,3)4/h6,8-13,16-17H,5,7,14-15H2,1-4H3/b22-17-InChIKey
PWLFPAJMEHKWTC-XLNRJJMWSA-NSynonyms
(5Z)5((3(3(4TERTBUTYLPHENOXY)PROPOXY)PHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3(3(4TERTBUTYLPHENOXY)PROPOXY)BENZYLIDENE)3ETHYL2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=CC(=CC=C2)OCCCOC3=CC=C(C=C3)C(C)(C)C)SC1=S
CCN1C(=S)SC(=Cc2cccc(c2)OCCCOc2ccc(cc2)C(C)(C)C)C1=O
InChI=1SC25H29NO3S2c152623(27)22(3124(26)30)171886921(1618)29157142820121019(111320)25(23)4h68131617H571415H214H3b2217
MFCD05976759
STK019540
ZINC000013940292
ZINC13940292
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