Vitas-M small molecule compound
2-({4-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-2-ethoxy-6-iodophenoxy}methyl)benzonitrile
Catalog ID
STK160527
SMILES CCOc1cc(/C=C\2/NC(=O)NC2=O)cc(c1OCc1ccccc1C#N)I
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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 C20H16IN3O4 MW 489.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16IN3O4/c1-2-27-17-9-12(8-16-19(25)24-20(26)23-16)7-15(21)18(17)28-11-14-6-4-3-5-13(14)10-22/h3-9H,2,11H2,1H3,(H2,23,24,25,26)/b16-8+InChIKey
QCYPKAMZCVJLAK-LZYBPNLTSA-NSynonyms
2((4((E)(25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)2ETHOXY6IODOPHENOXY)METHYL)BENZONITRILE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N2)I)OCC3=CC=CC=C3C#N
CCOc1cc(C=C2NC(=O)NC2=O)cc(c1OCc1ccccc1C#N)I
InChI=1SC20H16IN3O4c122717912(81619(25)2420(26)2316)715(21)18(17)281114643513(14)1022h39H211H21H3(H223242526)b168+
MFCD03231790
ZINC000000658596
ZINC00658596
ZINC658596
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