Vitas-M small molecule compound

methyl [(5Z)-5-(4-ethoxy-3-methoxybenzylidene)-3-methyl-4-oxo-2-thioxoimidazolidin-1-yl]acetate

Catalog ID
STL369383
SMILES CCOc1ccc(cc1OC)/C=C/1\N(CC(=O)OC)C(=S)N(C1=O)C

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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 C17H20N2O5S MW 364.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O5S/c1-5-24-13-7-6-11(9-14(13)22-3)8-12-16(21)18(2)17(25)19(12)10-15(20)23-4/h6-9H,5,10H2,1-4H3/b12-8-
InChIKey
DBDIWFHKYAQKED-WQLSENKSSA-N
Synonyms

CCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)N2CC(=O)OC)C)OC
CCOc1ccc(cc1OC)C=C1N(CC(=O)OC)C(=S)N(C1=O)C
InChI=1SC17H20N2O5Sc1524137611(914(13)223)81216(21)18(2)17(25)19(12)1015(20)234h69H510H214H3b128
methyl((5Z)5(4ethoxy3methoxybenzylidene)3methyl4oxo2thioxoimidazolidin1yl)acetate
METHYL2((5Z)5((4ETHOXY3METHOXYPHENYL)METHYLIDENE)3METHYL4OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)ACETATE
MFCD03721935
ZINC000002831012
ZINC02831012
ZINC2831012

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.