Vitas-M small molecule compound
(5Z)-3-ethyl-5-(2-{3-[5-methyl-2-(propan-2-yl)phenoxy]propoxy}benzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK076543
SMILES CCN1C(=S)S/C(=C\c2ccccc2OCCCOc2cc(C)ccc2C(C)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/c1-5-26-24(27)23(31-25(26)30)16-19-9-6-7-10-21(19)28-13-8-14-29-22-15-18(4)11-12-20(22)17(2)3/h6-7,9-12,15-17H,5,8,13-14H2,1-4H3/b23-16-InChIKey
DCNSIFRCAWTARB-KQWNVCNZSA-NSynonyms
(5Z)3ethyl5((2(3(5methyl2propan2ylphenoxy)propoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5Z)3ETHYL5(2(3(5METHYL2(PROPAN2YL)PHENOXY)PROPOXY)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=CC=CC=C2OCCCOC3=C(C=CC(=C3)C)C(C)C)SC1=S
CCN1C(=S)SC(=Cc2ccccc2OCCCOc2cc(C)ccc2C(C)C)C1=O
InChI=1SC25H29NO3S2c152624(27)23(3125(26)30)16199671021(19)281381429221518(4)111220(22)17(2)3h679121517H581314H214H3b2316
MFCD05976767
STK076543
ZINC000020149768
ZINC20149768
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