Vitas-M small molecule compound

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

Catalog ID
STK036955
SMILES COC(=O)CN1C(=S)N(C(=O)/C/1=C/c1ccc(cc1)OC)c1ccccc1

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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 C20H18N2O4S MW 382.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O4S/c1-25-16-10-8-14(9-11-16)12-17-19(24)22(15-6-4-3-5-7-15)20(27)21(17)13-18(23)26-2/h3-12H,13H2,1-2H3/b17-12-
InChIKey
RUGSPSQYNOKBOP-ATVHPVEESA-N
Synonyms

COC(=O)CN1C(=S)N(C(=O)C1=Cc1ccc(cc1)OC)c1ccccc1
COC1=CC=C(C=C1)C=C2C(=O)N(C(=S)N2CC(=O)OC)C3=CC=CC=C3
InChI=1SC20H18N2O4Sc1251610814(91116)121719(24)22(156435715)20(27)21(17)1318(23)262h312H13H212H3b1712
METHYL((5Z)5(4METHOXYBENZYLIDENE)4OXO3PHENYL2THIOXOIMIDAZOLIDIN1YL)ACETATE
METHYL2((5Z)5((4METHOXYPHENYL)METHYLIDENE)4OXO3PHENYL2SULFANYLIDENEIMIDAZOLIDIN1YL)ACETATE
MFCD04086800
STK036955
ZINC000013942111
ZINC13942111

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Available files

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