Vitas-M small molecule compound
2-({4-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}methyl)benzonitrile
Catalog ID
STK287699
SMILES COc1cc(ccc1OCc1ccccc1C#N)/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/c1-30-24-13-17(10-11-23(24)31-16-19-7-3-2-6-18(19)14-26)12-20(15-27)25-28-21-8-4-5-9-22(21)29-25/h2-13H,16H2,1H3,(H,28,29)/b20-12-InChIKey
QFINGYVALJYIBV-NDENLUEZSA-NSynonyms
2((4((Z)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)2METHOXYPHENOXY)METHYL)BENZONITRILE
COC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC4=CC=CC=C4C#N
COc1cc(ccc1OCc1ccccc1C#N)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC25H18N4O2c130241317(101123(24)311619732618(19)1426)1220(1527)252821845922(21)2925h213H16H21H3(H2829)b2012
MFCD09271035
ZINC000013943561
ZINC13943561
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