Vitas-M small molecule compound
ethyl (4-{(E)-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl}-2-ethoxyphenoxy)acetate
Catalog ID
STK162513
SMILES CCOc1cc(ccc1OCC(=O)OCC)/C=C\1/NC(=O)N(C1=O)c1cccc(c1)Cl
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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 C22H21ClN2O6 MW 444.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O6/c1-3-29-19-11-14(8-9-18(19)31-13-20(26)30-4-2)10-17-21(27)25(22(28)24-17)16-7-5-6-15(23)12-16/h5-12H,3-4,13H2,1-2H3,(H,24,28)/b17-10+InChIKey
FOQQTMAQENGEIC-LICLKQGHSA-NSynonyms
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)N2)C3=CC(=CC=C3)Cl)OCC(=O)OCC
CCOc1cc(ccc1OCC(=O)OCC)C=C1NC(=O)N(C1=O)c1cccc(c1)Cl
ETHYL(4((E)(1(3CHLOROPHENYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)2ETHOXYPHENOXY)ACETATE
ETHYL2(4((E)(1(3CHLOROPHENYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)2ETHOXYPHENOXY)ACETATE
InChI=1SC22H21ClN2O6c1329191114(8918(19)311320(26)3042)101721(27)25(22(28)2417)1675615(23)1216h512H3413H212H3(H2428)b1710+
MFCD04571333
ZINC000003659090
ZINC03659090
ZINC3659090
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