Vitas-M small molecule compound
(2E)-3-(4-hydroxy-3-iodo-5-methoxyphenyl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile
Catalog ID
STL405717
SMILES N#C/C(=C\c1cc(I)c(c(c1)OC)O)/C(=O)N1CCOCC1
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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 C15H15IN2O4 MW 414.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15IN2O4/c1-21-13-8-10(7-12(16)14(13)19)6-11(9-17)15(20)18-2-4-22-5-3-18/h6-8,19H,2-5H2,1H3/b11-6+InChIKey
XTFYLMXULMBPOG-IZZDOVSWSA-NSynonyms
(2E)3(4hydroxy3iodo5methoxyphenyl)2(morpholin4ylcarbonyl)prop2enenitrile
(E)3(4hydroxy3iodo5methoxyphenyl)2(morpholine4carbonyl)prop2enenitrile
COC1=C(C(=CC(=C1)C=C(C#N)C(=O)N2CCOCC2)I)O
InChI=1SC15H15IN2O4c12113810(712(16)14(13)19)611(917)15(20)1824225318h6819H25H21H3b116+
MFCD04227262
N#CC(=Cc1cc(I)c(c(c1)OC)O)C(=O)N1CCOCC1
ZINC000001410697
ZINC1410697
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