Vitas-M small molecule compound
4-({4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}methyl)benzonitrile
Catalog ID
STL407080
SMILES N#Cc1ccc(cc1)COc1ccc(cc1OC)/C=C(/c1nc2c([nH]1)cccc2)\C#N
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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 C25H18N4O2 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N4O2/c1-30-24-13-19(10-11-23(24)31-16-18-8-6-17(14-26)7-9-18)12-20(15-27)25-28-21-4-2-3-5-22(21)29-25/h2-13H,16H2,1H3,(H,28,29)/b20-12+InChIKey
WXKDCCUOVGZKJP-UDWIEESQSA-NSynonyms
4((4((E)2(1Hbenzimidazol2yl)2cyanoethenyl)2methoxyphenoxy)methyl)benzonitrile
COC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC4=CC=C(C=C4)C#N
InChI=1SC25H18N4O2c130241319(101123(24)3116188617(1426)7918)1220(1527)252821423522(21)2925h213H16H21H3(H2829)b2012+
MFCD06760582
N#Cc1ccc(cc1)COc1ccc(cc1OC)C=C(c1nc2c((nH)1)cccc2)C#N
ZINC000009187366
ZINC09187366
ZINC9187366
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