Vitas-M small molecule compound
{5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetic acid
Catalog ID
STK285173
SMILES COc1ccc(cc1OCC(=O)O)/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 C19H15N3O4 MW 349.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O4/c1-25-16-7-6-12(9-17(16)26-11-18(23)24)8-13(10-20)19-21-14-4-2-3-5-15(14)22-19/h2-9H,11H2,1H3,(H,21,22)(H,23,24)/b13-8+InChIKey
DDVCJJKFYLLLPX-MDWZMJQESA-NSynonyms
(5((E)2(1Hbenzimidazol2yl)2cyanoethenyl)2methoxyphenoxy)aceticacid
2(5((E)2(1Hbenzimidazol2yl)2cyanoethenyl)2methoxyphenoxy)aceticacid
COC1=C(C=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC(=O)O
COc1ccc(cc1OCC(=O)O)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC19H15N3O4c125167612(917(16)261118(23)24)813(1020)192114423515(14)2219h29H11H21H3(H2122)(H2324)b138+
MFCD08087414
ZINC000008017442
ZINC8017442
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