Vitas-M small molecule compound
{2-[(E)-{1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl]-6-methoxyphenoxy}acetic acid
Catalog ID
STK207539
SMILES COc1cccc(c1OCC(=O)O)/C=C\1/NC(=O)N(C1=O)CC(=O)Nc1ccc2c(c1)OCO2
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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 C22H19N3O9 MW 469.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O9/c1-31-16-4-2-3-12(20(16)32-10-19(27)28)7-14-21(29)25(22(30)24-14)9-18(26)23-13-5-6-15-17(8-13)34-11-33-15/h2-8H,9-11H2,1H3,(H,23,26)(H,24,30)(H,27,28)/b14-7+InChIKey
ZMGGLHANAGXMNP-VGOFMYFVSA-NSynonyms
(2((E)(1(2(13BENZODIOXOL5YLAMINO)2OXOETHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)6METHOXYPHENOXY)ACETICACID
2(2((E)(1(2(13benzodioxol5ylamino)2oxoethyl)25dioxoimidazolidin4ylidene)methyl)6methoxyphenoxy)aceticacid
COC1=CC=CC(=C1OCC(=O)O)C=C2C(=O)N(C(=O)N2)CC(=O)NC3=CC4=C(C=C3)OCO4
COc1cccc(c1OCC(=O)O)C=C1NC(=O)N(C1=O)CC(=O)Nc1ccc2c(c1)OCO2
InChI=1SC22H19N3O9c1311642312(20(16)321019(27)28)71421(29)25(22(30)2414)918(26)2313561517(813)34113315h28H911H21H3(H2326)(H2430)(H2728)b147+
MFCD07433659
ZINC000009235897
ZINC9235897
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