Vitas-M small molecule compound

(2E)-2-(1H-benzimidazol-2-yl)-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enenitrile

Catalog ID
STK389092
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)/c1nc2c([nH]1)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 C21H12F3N3O MW 379.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12F3N3O/c22-21(23,24)15-5-3-4-13(10-15)19-9-8-16(28-19)11-14(12-25)20-26-17-6-1-2-7-18(17)27-20/h1-11H,(H,26,27)/b14-11+
InChIKey
UBUCCDRFSOZMKS-SDNWHVSQSA-N
Synonyms

(2E)2(1HBENZIMIDAZOL2YL)3(5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)PROP2ENENITRILE
(2E)2BENZIMIDAZOL2YL3(5(3(TRIFLUOROMETHYL)PHENYL)(2FURYL))PROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)PROP2ENENITRILE
(E)2(1Hbenzo(d)imidazol2yl)3(5(3(trifluoromethyl)phenyl)furan2yl)acrylonitrile
C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F)C#N
InChI=1SC21H12F3N3Oc2221(2324)1553413(1015)199816(2819)1114(1225)202617612718(17)2720h111H(H2627)b1411+
MFCD01446191
N#CC(=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)c1nc2c((nH)1)cccc2
ZINC000004067463
ZINC04067463
ZINC4067463

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Available files

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