Vitas-M small molecule compound
(2E)-3-{5-chloro-2-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK760690
SMILES N#C/C(=C\c1cc(Cl)ccc1OCc1c(F)cccc1Cl)/c1[nH]c2c(n1)cc(cc2)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 C24H16Cl2FN3O MW 452.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16Cl2FN3O/c1-14-5-7-21-22(9-14)30-24(29-21)16(12-28)10-15-11-17(25)6-8-23(15)31-13-18-19(26)3-2-4-20(18)27/h2-11H,13H2,1H3,(H,29,30)/b16-10+InChIKey
NMKMUYNSVABGRG-MHWRWJLKSA-NSynonyms
(2E)3(5chloro2((2chloro6fluorobenzyl)oxy)phenyl)2(5methyl1Hbenzimidazol2yl)prop2enenitrile
(E)3(5CHLORO2((2CHLORO6FLUOROPHENYL)METHOXY)PHENYL)2(6METHYL1HBENZIMIDAZOL2YL)PROP2ENENITRILE
CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(C=CC(=C3)Cl)OCC4=C(C=CC=C4Cl)F)C#N
InChI=1SC24H16Cl2FN3Oc114572122(914)3024(2921)16(1228)10151117(25)6823(15)31131819(26)32420(18)27h211H13H21H3(H2930)b1610+
MFCD01819385
N#CC(=Cc1cc(Cl)ccc1OCc1c(F)cccc1Cl)c1(nH)c2c(n1)cc(cc2)C
ZINC000008854649
ZINC08854649
ZINC8854649
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