Vitas-M small molecule compound
(5Z)-5-(2-{3-[4-(butan-2-yl)phenoxy]propoxy}benzylidene)-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK022182
SMILES CCN1C(=S)S/C(=C\c2ccccc2OCCCOc2ccc(cc2)C(CC)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/c1-4-18(3)19-11-13-21(14-12-19)28-15-8-16-29-22-10-7-6-9-20(22)17-23-24(27)26(5-2)25(30)31-23/h6-7,9-14,17-18H,4-5,8,15-16H2,1-3H3/b23-17-InChIKey
UKIQMWHULYKVCD-QJOMJCCJSA-NSynonyms
(5Z)5((2(3(4BUTAN2YLPHENOXY)PROPOXY)PHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(2(3(4(BUTAN2YL)PHENOXY)PROPOXY)BENZYLIDENE)3ETHYL2THIOXO13THIAZOLIDIN4ONE
CCC(C)C1=CC=C(C=C1)OCCCOC2=CC=CC=C2C=C3C(=O)N(C(=S)S3)CC
CCN1C(=S)SC(=Cc2ccccc2OCCCOc2ccc(cc2)C(CC)C)C1=O
InChI=1SC25H29NO3S2c1418(3)19111321(141219)281581629221076920(22)172324(27)26(52)25(30)3123h679141718H4581516H213H3b2317
MFCD05976768
STK022182
ZINC000009057241
ZINC000009057242
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