Vitas-M small molecule compound
methyl 3-{5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl}benzoate
Catalog ID
STL388345
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)C(=O)OC)/c1nc2c([nH]1)cc(cc2)C
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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 C23H17N3O3 MW 383.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O3/c1-14-6-8-19-20(10-14)26-22(25-19)17(13-24)12-18-7-9-21(29-18)15-4-3-5-16(11-15)23(27)28-2/h3-12H,1-2H3,(H,25,26)/b17-12+InChIKey
OHPYHMRVUXCRBR-SFQUDFHCSA-NSynonyms
CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(O3)C4=CC(=CC=C4)C(=O)OC)C#N
InChI=1SC23H17N3O3c114681920(1014)2622(2519)17(1324)12187921(2918)1543516(1115)23(27)282h312H12H3(H2526)b1712+
METHYL3(5((1E)2CYANO2(6METHYLBENZIMIDAZOL2YL)VINYL)2FURYL)BENZOATE
methyl3(5((E)2cyano2(6methyl1Hbenzimidazol2yl)ethenyl)furan2yl)benzoate
MFCD01788013
N#CC(=Cc1ccc(o1)c1cccc(c1)C(=O)OC)c1nc2c((nH)1)cc(cc2)C
ZINC000004452833
ZINC04452833
ZINC4452833
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