Vitas-M small molecule compound
(2E)-2-cyano-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
Catalog ID
STL017018
SMILES N#C/C(=C\c1ccc(c(c1)OC)O)/C(=O)Nc1ncc(s1)Cc1ccc(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 C21H16FN3O3S MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FN3O3S/c1-28-19-10-14(4-7-18(19)26)8-15(11-23)20(27)25-21-24-12-17(29-21)9-13-2-5-16(22)6-3-13/h2-8,10,12,26H,9H2,1H3,(H,24,25,27)/b15-8+InChIKey
WDONQYGRFKVGRE-OVCLIPMQSA-NSynonyms
(2E)2CYANON(5((4FLUOROPHENYL)METHYL)(13THIAZOL2YL))3(4HYDROXY3METHOXYPHENYL)PROP2ENAMIDE
(2E)2cyanoN(5(4fluorobenzyl)13thiazol2yl)3(4hydroxy3methoxyphenyl)prop2enamide
(E)2CYANON(5((4FLUOROPHENYL)METHYL)13THIAZOL2YL)3(4HYDROXY3METHOXYPHENYL)PROP2ENAMIDE
COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)F)O
InChI=1SC21H16FN3O3Sc128191014(4718(19)26)815(1123)20(27)2521241217(2921)9132516(22)6313h28101226H9H21H3(H242527)b158+
MFCD02979304
N#CC(=Cc1ccc(c(c1)OC)O)C(=O)Nc1ncc(s1)Cc1ccc(cc1)F
ZINC000016713185
ZINC16713185
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