Vitas-M small molecule compound
(5Z)-5-{3-ethoxy-4-[(4-methylbenzyl)oxy]benzylidene}-3-(4-ethylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK061408
SMILES CCOc1cc(ccc1OCc1ccc(cc1)C)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)CC
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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 C28H27NO3S2 MW 489.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO3S2/c1-4-20-10-13-23(14-11-20)29-27(30)26(34-28(29)33)17-22-12-15-24(25(16-22)31-5-2)32-18-21-8-6-19(3)7-9-21/h6-17H,4-5,18H2,1-3H3/b26-17-InChIKey
OBGPFEWNKOGVHY-ONUIUJJFSA-NSynonyms
(5Z)5((3ETHOXY4((4METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)3(4ETHYLPHENYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3ETHOXY4((4METHYLBENZYL)OXY)BENZYLIDENE)3(4ETHYLPHENYL)2THIOXO13THIAZOLIDIN4ONE
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)C)OCC)SC2=S
CCOc1cc(ccc1OCc1ccc(cc1)C)C=C1SC(=S)N(C1=O)c1ccc(cc1)CC
InChI=1SC28H27NO3S2c1420101323(141120)2927(30)26(3428(29)33)1722121524(25(1622)3152)3218218619(3)7921h617H4518H213H3b2617
MFCD08051559
STK061408
ZINC000009553575
ZINC09553575
ZINC9553575
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