Vitas-M small molecule compound
(5E)-5-(3-chloro-5-ethoxy-4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK097153
SMILES CCOc1cc(/C=C\2/SC(=S)N(C2=O)C)cc(c1OCCOc1ccc(cc1OC)CC=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 C25H26ClNO5S2 MW 520.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClNO5S2/c1-5-7-16-8-9-19(20(13-16)29-4)31-10-11-32-23-18(26)12-17(14-21(23)30-6-2)15-22-24(28)27(3)25(33)34-22/h5,8-9,12-15H,1,6-7,10-11H2,2-4H3/b22-15+InChIKey
SIMAEBWODZCRQE-PXLXIMEGSA-NSynonyms
(5E)5((3chloro5ethoxy4(2(2methoxy4prop2enylphenoxy)ethoxy)phenyl)methylidene)3methyl2sulfanylidene13thiazolidin4one
(5E)5(3CHLORO5ETHOXY4(2(2METHOXY4(PROP2EN1YL)PHENOXY)ETHOXY)BENZYLIDENE)3METHYL2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)C)Cl)OCCOC3=C(C=C(C=C3)CC=C)OC
CCOc1cc(C=C2SC(=S)N(C2=O)C)cc(c1OCCOc1ccc(cc1OC)CC=C)Cl
InChI=1SC25H26ClNO5S2c157168919(20(1316)294)311011322318(26)1217(1421(23)3062)152224(28)27(3)25(33)3422h5891215H1671011H224H3b2215+
MFCD08672734
STK097153
ZINC000009762107
ZINC09762107
ZINC9762107
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