Vitas-M small molecule compound
2-{2-chloro-4-[(Z)-2-cyano-2-(5-methoxy-1H-benzimidazol-2-yl)ethenyl]phenoxy}-N-(4-methylphenyl)acetamide
Catalog ID
STK201856
SMILES COc1ccc2c(c1)nc([nH]2)/C(=C\c1ccc(c(c1)Cl)OCC(=O)Nc1ccc(cc1)C)/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 C26H21ClN4O3 MW 472.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN4O3/c1-16-3-6-19(7-4-16)29-25(32)15-34-24-10-5-17(12-21(24)27)11-18(14-28)26-30-22-9-8-20(33-2)13-23(22)31-26/h3-13H,15H2,1-2H3,(H,29,32)(H,30,31)/b18-11-InChIKey
DFMSPRIZXVFFFR-WQRHYEAKSA-NSynonyms
2(2CHLORO4((Z)2CYANO2(5METHOXY1HBENZIMIDAZOL2YL)ETHENYL)PHENOXY)N(4METHYLPHENYL)ACETAMIDE
2(2CHLORO4((Z)2CYANO2(6METHOXY1HBENZIMIDAZOL2YL)ETHENYL)PHENOXY)N(4METHYLPHENYL)ACETAMIDE
CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=C(C#N)C3=NC4=C(N3)C=C(C=C4)OC)Cl
COc1ccc2c(c1)nc((nH)2)C(=Cc1ccc(c(c1)Cl)OCC(=O)Nc1ccc(cc1)C)C#N
InChI=1SC26H21ClN4O3c1163619(7416)2925(32)15342410517(1221(24)27)1118(1428)2630229820(332)1323(22)3126h313H15H212H3(H2932)(H3031)b1811
MFCD06001768
ZINC000009934929
ZINC09934929
ZINC9934929
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