Vitas-M small molecule compound
(5E)-5-(3-chloro-5-ethoxy-4-{3-[5-methyl-2-(propan-2-yl)phenoxy]propoxy}benzylidene)-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK022335
SMILES CCOc1cc(/C=C\2/SC(=S)N(C2=O)C)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 C26H30ClNO4S2 MW 520.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30ClNO4S2/c1-6-30-22-14-18(15-23-25(29)28(5)26(33)34-23)13-20(27)24(22)32-11-7-10-31-21-12-17(4)8-9-19(21)16(2)3/h8-9,12-16H,6-7,10-11H2,1-5H3/b23-15+InChIKey
PTWKLEJQRGUDRO-HZHRSRAPSA-NSynonyms
(5E)5((3chloro5ethoxy4(3(5methyl2propan2ylphenoxy)propoxy)phenyl)methylidene)3methyl2sulfanylidene13thiazolidin4one
(5E)5(3CHLORO5ETHOXY4(3(5METHYL2(PROPAN2YL)PHENOXY)PROPOXY)BENZYLIDENE)3METHYL2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)C)Cl)OCCCOC3=C(C=CC(=C3)C)C(C)C
CCOc1cc(C=C2SC(=S)N(C2=O)C)cc(c1OCCCOc1cc(C)ccc1C(C)C)Cl
InChI=1SC26H30ClNO4S2c1630221418(152325(29)28(5)26(33)3423)1320(27)24(22)321171031211217(4)8919(21)16(2)3h891216H671011H215H3b2315+
MFCD08049908
STK022335
ZINC000013940431
ZINC13940431
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