Vitas-M small molecule compound
(2E)-2-(acetylamino)-3-{4-[(3-fluorobenzyl)oxy]-3-iodo-5-methoxyphenyl}prop-2-enoic acid
Catalog ID
STL360342
SMILES COc1cc(/C=C(\C(=O)O)/NC(=O)C)cc(c1OCc1cccc(c1)F)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 C19H17FINO5 MW 485.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17FINO5/c1-11(23)22-16(19(24)25)8-13-7-15(21)18(17(9-13)26-2)27-10-12-4-3-5-14(20)6-12/h3-9H,10H2,1-2H3,(H,22,23)(H,24,25)/b16-8+InChIKey
AYDDSDHXABUKNN-LZYBPNLTSA-NSynonyms
799827-94-4(2E)2(acetylamino)3(4((3fluorobenzyl)oxy)3iodo5methoxyphenyl)prop2enoicacid
(E)2acetamido3(4((3fluorobenzyl)oxy)3iodo5methoxyphenyl)acrylicacid
(E)2ACETAMIDO3(4((3FLUOROPHENYL)METHOXY)3IODO5METHOXYPHENYL)PROP2ENOICACID
799827944
CC(=O)NC(=CC1=CC(=C(C(=C1)I)OCC2=CC(=CC=C2)F)OC)C(=O)O
COc1cc(C=C(C(=O)O)NC(=O)C)cc(c1OCc1cccc(c1)F)I
InChI=1SC19H17FINO5c111(23)2216(19(24)25)813715(21)18(17(913)262)27101243514(20)612h39H10H212H3(H2223)(H2425)b168+
MFCD03683629
ZINC000002240503
ZINC2240503
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