Vitas-M small molecule compound
(2E)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-fluorophenyl)prop-2-enenitrile
Catalog ID
STK200949
SMILES N#C/C(=C/c1cc2OCOc2cc1Cl)/c1ccc(cc1)F
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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 C16H9ClFNO2 MW 301.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9ClFNO2/c17-14-7-16-15(20-9-21-16)6-11(14)5-12(8-19)10-1-3-13(18)4-2-10/h1-7H,9H2/b12-5-InChIKey
NFJWLTCVQUSNBT-XGICHPGQSA-NSynonyms
(2E)3(6CHLORO13BENZODIOXOL5YL)2(4FLUOROPHENYL)PROP2ENENITRILE
(E)3(6CHLORO13BENZODIOXOL5YL)2(4FLUOROPHENYL)PROP2ENENITRILE
C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C3=CC=C(C=C3)F)Cl
InChI=1SC16H9ClFNO2c171471615(2092116)611(14)512(819)101313(18)4210h17H9H2b125
MFCD06003807
N#CC(=Cc1cc2OCOc2cc1Cl)c1ccc(cc1)F
ZINC000004739639
ZINC04739639
ZINC4739639
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