Vitas-M small molecule compound
3-{5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}-4-methylbenzoic acid
Catalog ID
STK114106
SMILES N#C/C(=C/c1ccc(o1)c1cc(ccc1C)C(=O)O)/c1nc2c([nH]1)cccc2
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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 C22H15N3O3 MW 369.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15N3O3/c1-13-6-7-14(22(26)27)11-17(13)20-9-8-16(28-20)10-15(12-23)21-24-18-4-2-3-5-19(18)25-21/h2-11H,1H3,(H,24,25)(H,26,27)/b15-10-InChIKey
KWGMJUKCWOTQKS-GDNBJRDFSA-NSynonyms
3(5((Z)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)FURAN2YL)4METHYLBENZOICACID
CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)C=C(C#N)C3=NC4=CC=CC=C4N3
InChI=1SC22H15N3O3c1136714(22(26)27)1117(13)209816(2820)1015(1223)212418423519(18)2521h211H1H3(H2425)(H2627)b1510
MFCD04212972
N#CC(=Cc1ccc(o1)c1cc(ccc1C)C(=O)O)c1nc2c((nH)1)cccc2
ZINC000004453649
ZINC4453649
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