Vitas-M small molecule compound

(2E)-2-cyano-N-cyclohexyl-3-(3-ethoxy-4-hydroxy-5-iodophenyl)prop-2-enamide

Catalog ID
STK041662
SMILES CCOc1cc(/C=C(/C(=O)NC2CCCCC2)\C#N)cc(c1O)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 C18H21IN2O3 MW 440.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21IN2O3/c1-2-24-16-10-12(9-15(19)17(16)22)8-13(11-20)18(23)21-14-6-4-3-5-7-14/h8-10,14,22H,2-7H2,1H3,(H,21,23)/b13-8+
InChIKey
NPMZXZOEYQSSNX-MDWZMJQESA-N
Synonyms

(2E)2CYANONCYCLOHEXYL3(3ETHOXY4HYDROXY5IODOPHENYL)PROP2ENAMIDE
(E)2CYANONCYCLOHEXYL3(3ETHOXY4HYDROXY5IODOPHENYL)PROP2ENAMIDE
CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2CCCCC2)I)O
CCOc1cc(C=C(C(=O)NC2CCCCC2)C#N)cc(c1O)I
InChI=1SC18H21IN2O3c1224161012(915(19)17(16)22)813(1120)18(23)21146435714h8101422H27H21H3(H2123)b138+
MFCD05040636
STK041662
ZINC000013942527
ZINC13942527

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Available files

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