Vitas-M small molecule compound
(5E)-5-(3-chloro-5-ethoxy-4-{3-[5-methyl-2-(propan-2-yl)phenoxy]propoxy}benzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK038296
SMILES CCOc1cc(/C=C\2/SC(=S)NC2=O)cc(c1OCCCOc1cc(C)ccc1C(C)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 C25H28ClNO4S2 MW 506.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClNO4S2/c1-5-29-21-13-17(14-22-24(28)27-25(32)33-22)12-19(26)23(21)31-10-6-9-30-20-11-16(4)7-8-18(20)15(2)3/h7-8,11-15H,5-6,9-10H2,1-4H3,(H,27,28,32)/b22-14+InChIKey
WKIVLILQWMOAAT-HYARGMPZSA-NSynonyms
(5E)5((3chloro5ethoxy4(3(5methyl2propan2ylphenoxy)propoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)5(3CHLORO5ETHOXY4(3(5METHYL2(PROPAN2YL)PHENOXY)PROPOXY)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)S2)Cl)OCCCOC3=C(C=CC(=C3)C)C(C)C
CCOc1cc(C=C2SC(=S)NC2=O)cc(c1OCCCOc1cc(C)ccc1C(C)C)Cl
InChI=1SC25H28ClNO4S2c1529211317(142224(28)2725(32)3322)1219(26)23(21)31106930201116(4)7818(20)15(2)3h781115H56910H214H3(H272832)b2214+
MFCD08050568
STK038296
ZINC000009299680
ZINC09299680
ZINC9299680
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