Vitas-M small molecule compound
(5Z)-5-(5-bromo-2-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}benzylidene)-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK095602
SMILES C=CCN1C(=S)S/C(=C\c2cc(Br)ccc2OCCOc2cc(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 C25H26BrNO3S2 MW 532.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26BrNO3S2/c1-5-10-27-24(28)23(32-25(27)31)15-18-14-19(26)7-9-21(18)29-11-12-30-22-13-17(4)6-8-20(22)16(2)3/h5-9,13-16H,1,10-12H2,2-4H3/b23-15-InChIKey
YBALODYNBACSEA-HAHDFKILSA-NSynonyms
(5Z)5((5BROMO2(2(5METHYL2PROPAN2YLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(5BROMO2(2(5METHYL2(PROPAN2YL)PHENOXY)ETHOXY)BENZYLIDENE)3(PROP2EN1YL)2THIOXO13THIAZOLIDIN4ONE
C=CCN1C(=S)SC(=Cc2cc(Br)ccc2OCCOc2cc(C)ccc2C(C)C)C1=O
CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)Br)C=C3C(=O)N(C(=S)S3)CC=C
InChI=1SC25H26BrNO3S2c15102724(28)23(3225(27)31)15181419(26)7921(18)29111230221317(4)6820(22)16(2)3h591316H11012H224H3b2315
MFCD02109284
STK095602
ZINC000100080867
ZINC100080867
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