Vitas-M small molecule compound

(5E)-5-(4-ethoxy-3-methoxybenzylidene)-3-(2-methoxyethyl)-2-thioxoimidazolidin-4-one

Catalog ID
STL416541
SMILES COCCN1C(=S)N/C(=C/c2ccc(c(c2)OC)OCC)/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 C16H20N2O4S MW 336.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O4S/c1-4-22-13-6-5-11(10-14(13)21-3)9-12-15(19)18(7-8-20-2)16(23)17-12/h5-6,9-10H,4,7-8H2,1-3H3,(H,17,23)/b12-9+
InChIKey
SZOCTMKWVIEAIZ-FMIVXFBMSA-N
Synonyms

(5E)5((4ETHOXY3METHOXYPHENYL)METHYLIDENE)3(2METHOXYETHYL)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5E)5(4ethoxy3methoxybenzylidene)3(2methoxyethyl)2thioxoimidazolidin4one
CCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)N2)CCOC)OC
COCCN1C(=S)NC(=Cc2ccc(c(c2)OC)OCC)C1=O
InChI=1SC16H20N2O4Sc1422136511(1014(13)213)91215(19)18(78202)16(23)1712h56910H478H213H3(H1723)b129+
MFCD30707053
ZINC000035419342
ZINC35419342

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Available files

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