Vitas-M small molecule compound

(5E)-5-(4-{3-[4-(butan-2-yl)phenoxy]propoxy}-3-ethoxybenzylidene)-3-phenyl-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK022216
SMILES CCOc1cc(ccc1OCCCOc1ccc(cc1)C(CC)C)/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 C31H33NO4S2 MW 547.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33NO4S2/c1-4-22(3)24-13-15-26(16-14-24)35-18-9-19-36-27-17-12-23(20-28(27)34-5-2)21-29-30(33)32(31(37)38-29)25-10-7-6-8-11-25/h6-8,10-17,20-22H,4-5,9,18-19H2,1-3H3/b29-21+
InChIKey
CBZBDQQFGVZDNC-XHLNEMQHSA-N
Synonyms

(5E)5((4(3(4butan2ylphenoxy)propoxy)3ethoxyphenyl)methylidene)3phenyl2sulfanylidene13thiazolidin4one
(5E)5(4(3(4(BUTAN2YL)PHENOXY)PROPOXY)3ETHOXYBENZYLIDENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
CCC(C)C1=CC=C(C=C1)OCCCOC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4)OCC
CCOc1cc(ccc1OCCCOc1ccc(cc1)C(CC)C)C=C1SC(=S)N(C1=O)c1ccccc1
InChI=1SC31H33NO4S2c1422(3)24131526(161424)35189193627171223(2028(27)3452)212930(33)32(31(37)3829)25107681125h6810172022H4591819H213H3b2921+
MFCD08049905
STK022216
ZINC000097958045
ZINC000097958046

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Available files

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