Vitas-M small molecule compound
(4Z)-4-[4-(benzyloxy)-3-ethoxybenzylidene]-2-(ethylsulfanyl)-1,3-thiazol-5(4H)-one
Catalog ID
STK509348
SMILES CCOc1cc(ccc1OCc1ccccc1)/C=C/1\N=C(SC1=O)SCC
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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 C21H21NO3S2 MW 399.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO3S2/c1-3-24-19-13-16(12-17-20(23)27-21(22-17)26-4-2)10-11-18(19)25-14-15-8-6-5-7-9-15/h5-13H,3-4,14H2,1-2H3/b17-12-InChIKey
GNSORQIXIOLDDK-ATVHPVEESA-NSynonyms
(4Z)4((3ETHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)2ETHYLSULFANYL13THIAZOL5ONE
(4Z)4(4(benzyloxy)3ethoxybenzylidene)2(ethylsulfanyl)13thiazol5(4H)one
CCOC1=C(C=CC(=C1)C=C2C(=O)SC(=N2)SCC)OCC3=CC=CC=C3
CCOc1cc(ccc1OCc1ccccc1)C=C1N=C(SC1=O)SCC
InChI=1SC21H21NO3S2c1324191316(121720(23)2721(2217)2642)101118(19)2514158657915h513H3414H212H3b1712
MFCD02377970
ZINC000003000433
ZINC03000433
ZINC3000433
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