Vitas-M small molecule compound
(2E)-3-{4-[(2,4-dichlorobenzyl)oxy]-3-methoxyphenyl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK758188
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCc1ccc(cc1Cl)Cl)/c1nc2c([nH]1)ccc(c2)C
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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 C25H19Cl2N3O2 MW 464.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl2N3O2/c1-15-3-7-21-22(9-15)30-25(29-21)18(13-28)10-16-4-8-23(24(11-16)31-2)32-14-17-5-6-19(26)12-20(17)27/h3-12H,14H2,1-2H3,(H,29,30)/b18-10+InChIKey
STLQGTGUJDEHMZ-VCHYOVAHSA-NSynonyms
312632-40-9(2E)3(4((24dichlorobenzyl)oxy)3methoxyphenyl)2(5methyl1Hbenzimidazol2yl)prop2enenitrile
(E)3(4((24DICHLOROPHENYL)METHOXY)3METHOXYPHENYL)2(6METHYL1HBENZIMIDAZOL2YL)PROP2ENENITRILE
3(4((24DICHLOROBENZYL)OXY)3METHOXYPHENYL)2(5METHYL1HBENZIMIDAZOL2YL)ACRYLONITRILE
312632409
CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C=C3)OCC4=C(C=C(C=C4)Cl)Cl)OC)C#N
InChI=1SC25H19Cl2N3O2c115372122(915)3025(2921)18(1328)10164823(24(1116)312)3214175619(26)1220(17)27h312H14H212H3(H2930)b1810+
MFCD00851865
N#CC(=Cc1ccc(c(c1)OC)OCc1ccc(cc1Cl)Cl)c1nc2c((nH)1)ccc(c2)C
ZINC000006407980
ZINC06407980
ZINC6407980
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