Vitas-M small molecule compound
2-chlorobenzyl 4-{5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoate
Catalog ID
STK106116
SMILES N#C/C(=C/c1ccc(o1)c1ccc(cc1)C(=O)OCc1ccccc1Cl)/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 C28H18ClN3O3 MW 479.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H18ClN3O3/c29-23-6-2-1-5-20(23)17-34-28(33)19-11-9-18(10-12-19)26-14-13-22(35-26)15-21(16-30)27-31-24-7-3-4-8-25(24)32-27/h1-15H,17H2,(H,31,32)/b21-15-InChIKey
OOCLWHPWZVOPKN-QNGOZBTKSA-NSynonyms
(2chlorophenyl)methyl4(5((Z)2(1Hbenzimidazol2yl)2cyanoethenyl)furan2yl)benzoate
2CHLOROBENZYL4(5((Z)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)FURAN2YL)BENZOATE
C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)C3=CC=C(O3)C=C(C#N)C4=NC5=CC=CC=C5N4)Cl
InChI=1SC28H18ClN3O3c2923621520(23)173428(33)1911918(101219)26141322(3526)1521(1630)273124734825(24)3227h115H17H2(H3132)b2115
MFCD07546300
N#CC(=Cc1ccc(o1)c1ccc(cc1)C(=O)OCc1ccccc1Cl)c1nc2c((nH)1)cccc2
ZINC000009762918
ZINC09762918
ZINC9762918
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