Vitas-M small molecule compound
2-{4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}-N-(4-phenoxyphenyl)acetamide
Catalog ID
STK287282
SMILES COc1cc(ccc1OCC(=O)Nc1ccc(cc1)Oc1ccccc1)/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 C31H24N4O4 MW 516.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24N4O4/c1-37-29-18-21(17-22(19-32)31-34-26-9-5-6-10-27(26)35-31)11-16-28(29)38-20-30(36)33-23-12-14-25(15-13-23)39-24-7-3-2-4-8-24/h2-18H,20H2,1H3,(H,33,36)(H,34,35)/b22-17+InChIKey
GFQNGWSSHQJQKL-OQKWZONESA-NSynonyms
2(4((E)2(1Hbenzimidazol2yl)2cyanoethenyl)2methoxyphenoxy)N(4phenoxyphenyl)acetamide
COC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5
COc1cc(ccc1OCC(=O)Nc1ccc(cc1)Oc1ccccc1)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC31H24N4O4c137291821(1722(1932)3134269561027(26)3531)111628(29)382030(36)3323121425(151323)39247324824h218H20H21H3(H3336)(H3435)b2217+
MFCD06760583
ZINC000009187368
ZINC09187368
ZINC9187368
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