Vitas-M small molecule compound
(2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(2-fluoro-5-nitrophenyl)amino]prop-2-enenitrile
Catalog ID
STK803760
SMILES N#C/C(=C/Nc1cc(ccc1F)[N+](=O)[O-])/c1scc(n1)c1ccc2c(c1)OCO2
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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 C19H11FN4O4S MW 410.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H11FN4O4S/c20-14-3-2-13(24(25)26)6-15(14)22-8-12(7-21)19-23-16(9-29-19)11-1-4-17-18(5-11)28-10-27-17/h1-6,8-9,22H,10H2/b12-8-InChIKey
ONPMTVWOVMRRLR-WQLSENKSSA-NSynonyms
(2Z)2(4(13benzodioxol5yl)13thiazol2yl)3((2fluoro5nitrophenyl)amino)prop2enenitrile
(Z)2(4(13BENZODIOXOL5YL)13THIAZOL2YL)3(2FLUORO5NITROANILINO)PROP2ENENITRILE
(Z)2(4(benzo(d)(13)dioxol5yl)thiazol2yl)3((2fluoro5nitrophenyl)amino)acrylonitrile
C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)C(=CNC4=C(C=CC(=C4)(N+)(=O)(O))F)C#N
InChI=1SC19H11FN4O4Sc20143213(24(25)26)615(14)22812(721)192316(92919)11141718(511)28102717h168922H10H2b128
MFCD03670921
N#CC(=CNc1cc(ccc1F)(N+)(=O)(O))c1scc(n1)c1ccc2c(c1)OCO2
ZINC000005023025
ZINC5023025
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