Vitas-M small molecule compound
methyl [(5Z)-5-[4-(cyanomethoxy)-3-methoxybenzylidene]-3-(4-methoxyphenyl)-4-oxo-2-thioxoimidazolidin-1-yl]acetate
Catalog ID
STL375055
SMILES N#CCOc1ccc(cc1OC)/C=C\1/C(=O)N(C(=S)N1CC(=O)OC)c1ccc(cc1)OC
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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 C23H21N3O6S MW 467.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O6S/c1-29-17-7-5-16(6-8-17)26-22(28)18(25(23(26)33)14-21(27)31-3)12-15-4-9-19(32-11-10-24)20(13-15)30-2/h4-9,12-13H,11,14H2,1-3H3/b18-12-InChIKey
LYJHPYTXLLDOBT-PDGQHHTCSA-NSynonyms
COC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC#N)OC)N(C2=S)CC(=O)OC
InChI=1SC23H21N3O6Sc129177516(6817)2622(28)18(25(23(26)33)1421(27)313)12154919(32111024)20(1315)302h491213H1114H213H3b1812
methyl((5Z)5(4(cyanomethoxy)3methoxybenzylidene)3(4methoxyphenyl)4oxo2thioxoimidazolidin1yl)acetate
METHYL2((5Z)5((4(CYANOMETHOXY)3METHOXYPHENYL)METHYLIDENE)3(4METHOXYPHENYL)4OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)ACETATE
MFCD04086803
N#CCOc1ccc(cc1OC)C=C1C(=O)N(C(=S)N1CC(=O)OC)c1ccc(cc1)OC
ZINC000009296141
ZINC09296141
ZINC9296141
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