Vitas-M small molecule compound

(2E)-2-(1H-benzimidazol-2-yl)-3-{4-[(2,4-dichlorobenzyl)oxy]phenyl}prop-2-enenitrile

Catalog ID
STK756779
SMILES N#C/C(=C\c1ccc(cc1)OCc1ccc(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 C23H15Cl2N3O MW 420.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15Cl2N3O/c24-18-8-7-16(20(25)12-18)14-29-19-9-5-15(6-10-19)11-17(13-26)23-27-21-3-1-2-4-22(21)28-23/h1-12H,14H2,(H,27,28)/b17-11+
InChIKey
HBVNTKYIGWHEJL-GZTJUZNOSA-N
Synonyms

(2E)2(1Hbenzimidazol2yl)3(4((24dichlorobenzyl)oxy)phenyl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(4((24DICHLOROPHENYL)METHOXY)PHENYL)PROP2ENENITRILE
2(1HBENZIMIDAZOL2YL)3(4((24DICHLOROBENZYL)OXY)PHENYL)ACRYLONITRILE
C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC=C(C=C3)OCC4=C(C=C(C=C4)Cl)Cl)C#N
InChI=1SC23H15Cl2N3Oc24188716(20(25)1218)1429199515(61019)1117(1326)232721312422(21)2823h112H14H2(H2728)b1711+
MFCD01029770
N#CC(=Cc1ccc(cc1)OCc1ccc(cc1Cl)Cl)c1nc2c((nH)1)cccc2
ZINC000008405599
ZINC08405599
ZINC8405599

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Available files

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