Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enenitrile
Catalog ID
STK701964
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)/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 C21H11F3N2OS MW 396.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11F3N2OS/c22-21(23,24)15-5-3-4-13(10-15)18-9-8-16(27-18)11-14(12-25)20-26-17-6-1-2-7-19(17)28-20/h1-11H/b14-11+InChIKey
BHMINWATBQCYAR-SDNWHVSQSA-NSynonyms
(2E)2(13benzothiazol2yl)3(5(3(trifluoromethyl)phenyl)furan2yl)prop2enenitrile
(E)2(13BENZOTHIAZOL2YL)3(5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)PROP2ENENITRILE
(E)2(benzo(d)thiazol2yl)3(5(3(trifluoromethyl)phenyl)furan2yl)acrylonitrile
C1=CC=C2C(=C1)N=C(S2)C(=CC3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F)C#N
InChI=1SC21H11F3N2OSc2221(2324)1553413(1015)189816(2718)1114(1225)202617612719(17)2820h111Hb1411+
MFCD02993584
N#CC(=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)c1nc2c(s1)cccc2
ZINC000012531962
ZINC12531962
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