Vitas-M small molecule compound
2-({3-[(E)-2-cyano-2-(5-methoxy-1H-benzimidazol-2-yl)ethenyl]-2-methyl-1H-indol-1-yl}methyl)benzonitrile
Catalog ID
STK201849
SMILES N#C/C(=C\c1c(C)n(c2c1cccc2)Cc1ccccc1C#N)/c1nc2c([nH]1)ccc(c2)OC
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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 C28H21N5O MW 443.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N5O/c1-18-24(13-21(16-30)28-31-25-12-11-22(34-2)14-26(25)32-28)23-9-5-6-10-27(23)33(18)17-20-8-4-3-7-19(20)15-29/h3-14H,17H2,1-2H3,(H,31,32)/b21-13+InChIKey
DWCJYOJBZQIKPZ-FYJGNVAPSA-NSynonyms
2((3((E)2CYANO2(5METHOXY1HBENZIMIDAZOL2YL)ETHENYL)2METHYL1HINDOL1YL)METHYL)BENZONITRILE
2((3((E)2cyano2(6methoxy1Hbenzimidazol2yl)ethenyl)2methylindol1yl)methyl)benzonitrile
CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3C#N)C=C(C#N)C4=NC5=C(N4)C=C(C=C5)OC
InChI=1SC28H21N5Oc11824(1321(1630)283125121122(342)1426(25)3228)239561027(23)33(18)1720843719(20)1529h314H17H212H3(H3132)b2113+
MFCD06666672
N#CC(=Cc1c(C)n(c2c1cccc2)Cc1ccccc1C#N)c1nc2c((nH)1)ccc(c2)OC
ZINC000009263608
ZINC09263608
ZINC9263608
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