Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-[1-(2,4-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Catalog ID
STK757970
SMILES N#C/C(=C\c1cn(nc1c1ccccc1)Cc1ccc(cc1Cl)Cl)/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 C26H17Cl2N5 MW 470.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17Cl2N5/c27-21-11-10-18(22(28)13-21)15-33-16-20(25(32-33)17-6-2-1-3-7-17)12-19(14-29)26-30-23-8-4-5-9-24(23)31-26/h1-13,16H,15H2,(H,30,31)/b19-12+InChIKey
RGGBXRRGTBAYGP-XDHOZWIPSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(1(24dichlorobenzyl)3phenyl1Hpyrazol4yl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(1((24DICHLOROPHENYL)METHYL)3PHENYLPYRAZOL4YL)PROP2ENENITRILE
C1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C3=NC4=CC=CC=C4N3)CC5=C(C=C(C=C5)Cl)Cl
InChI=1SC26H17Cl2N5c2721111018(22(28)1321)15331620(25(3233)176213717)1219(1429)263023845924(23)3126h11316H15H2(H3031)b1912+
MFCD01160624
N#CC(=Cc1cn(nc1c1ccccc1)Cc1ccc(cc1Cl)Cl)c1nc2c((nH)1)cccc2
ZINC000008809518
ZINC08809518
ZINC8809518
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