Vitas-M small molecule compound
(2E)-2-(5-methoxy-1H-benzimidazol-2-yl)-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enenitrile
Catalog ID
STK201863
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)/c1nc2c([nH]1)ccc(c2)OC
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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 C22H14F3N3O2 MW 409.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14F3N3O2/c1-29-16-5-7-18-19(11-16)28-21(27-18)14(12-26)10-17-6-8-20(30-17)13-3-2-4-15(9-13)22(23,24)25/h2-11H,1H3,(H,27,28)/b14-10+InChIKey
HKQOFCXWUAKDJH-GXDHUFHOSA-NSynonyms
(2E)2(5METHOXY1HBENZIMIDAZOL2YL)3(5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)PROP2ENENITRILE
(E)2(6METHOXY1HBENZIMIDAZOL2YL)3(5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)PROP2ENENITRILE
COC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F)C#N
InChI=1SC22H14F3N3O2c12916571819(1116)2821(2718)14(1226)10176820(3017)1332415(913)22(2324)25h211H1H3(H2728)b1410+
MFCD06666677
N#CC(=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)c1nc2c((nH)1)ccc(c2)OC
ZINC000004739915
ZINC04739915
ZINC4739915
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