Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-[3-(3-fluoro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Catalog ID
STK815023
SMILES N#C/C(=C\c1cn(nc1c1ccc(c(c1)F)OC)c1ccccc1)/c1nc2c(s1)cccc2
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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 C26H17FN4OS MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17FN4OS/c1-32-23-12-11-17(14-21(23)27)25-19(16-31(30-25)20-7-3-2-4-8-20)13-18(15-28)26-29-22-9-5-6-10-24(22)33-26/h2-14,16H,1H3/b18-13+InChIKey
RNGDJSCCQGXLLD-QGOAFFKASA-NSynonyms
956987-06-7(2E)2(13benzothiazol2yl)3(3(3fluoro4methoxyphenyl)1phenyl1Hpyrazol4yl)prop2enenitrile
(E)2(13BENZOTHIAZOL2YL)3(3(3FLUORO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)PROP2ENENITRILE
956987067
COC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5)F
InChI=1SC26H17FN4OSc13223121117(1421(23)27)2519(1631(3025)207324820)1318(1528)2629229561024(22)3326h21416H1H3b1813+
MFCD04442468
N#CC(=Cc1cn(nc1c1ccc(c(c1)F)OC)c1ccccc1)c1nc2c(s1)cccc2
ZINC000009472381
ZINC09472381
ZINC9472381
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