Vitas-M small molecule compound
(2E)-3-[4-(benzyloxy)-3-iodo-5-methoxyphenyl]-2-(3-fluorophenyl)prop-2-enenitrile
Catalog ID
STK201587
SMILES COc1cc(/C=C(\c2cccc(c2)F)/C#N)cc(c1OCc1ccccc1)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 C23H17FINO2 MW 485.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17FINO2/c1-27-22-12-17(10-19(14-26)18-8-5-9-20(24)13-18)11-21(25)23(22)28-15-16-6-3-2-4-7-16/h2-13H,15H2,1H3/b19-10-InChIKey
UENFWRDSJFVIML-GRSHGNNSSA-NSynonyms
(2E)3(4(BENZYLOXY)3IODO5METHOXYPHENYL)2(3FLUOROPHENYL)PROP2ENENITRILE
(E)2(3FLUOROPHENYL)3(3IODO5METHOXY4PHENYLMETHOXYPHENYL)PROP2ENENITRILE
COC1=C(C(=CC(=C1)C=C(C#N)C2=CC(=CC=C2)F)I)OCC3=CC=CC=C3
COc1cc(C=C(c2cccc(c2)F)C#N)cc(c1OCc1ccccc1)I
InChI=1SC23H17FINO2c127221217(1019(1426)1885920(24)1318)1121(25)23(22)2815166324716h213H15H21H3b1910
MFCD06627337
ZINC000012393077
ZINC12393077
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