Vitas-M small molecule compound
2-{3-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid
Catalog ID
STK135451
SMILES N#C/C(=C/c1cc(n(c1C)c1ccccc1C(=O)O)C)/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 C23H18N4O2 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O2/c1-14-11-16(15(2)27(14)21-10-6-3-7-18(21)23(28)29)12-17(13-24)22-25-19-8-4-5-9-20(19)26-22/h3-12H,1-2H3,(H,25,26)(H,28,29)/b17-12-InChIKey
DRRLXWOFTBQDAV-ATVHPVEESA-NSynonyms
2(3((Z)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)25DIMETHYL1HPYRROL1YL)BENZOICACID
2(3((Z)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)25DIMETHYL1PYRROLYL)BENZOICACID
2(3((Z)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)25DIMETHYLPYRROL1YL)BENZOICACID
2(3((Z)2(1HBENZIMIDAZOL2YL)2CYANOVINYL)25DIMETHYLPYRROL1YL)BENZOICACID
2(3(2(1HBENZIMIDAZOL2YL)2CYANOVINYL)25DIMETHYL1HPYRROL1YL)BENZOICACID
CC1=CC(=C(N1C2=CC=CC=C2C(=O)O)C)C=C(C#N)C3=NC4=CC=CC=C4N3
InChI=1SC23H18N4O2c1141116(15(2)27(14)211063718(21)23(28)29)1217(1324)222519845920(19)2622h312H12H3(H2526)(H2829)b1712
MFCD04343812
N#CC(=Cc1cc(n(c1C)c1ccccc1C(=O)O)C)c1nc2c((nH)1)cccc2
ZINC000004677893
ZINC4677893
Check stock
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Check stock on Vitas-MAvailable files
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