Vitas-M small molecule compound

(2E)-2-(1H-benzimidazol-2-yl)-3-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}prop-2-enenitrile

Catalog ID
STK755324
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)/C=C(/c1nc2c([nH]1)cccc2)\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 C24H18ClN3O2 MW 415.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN3O2/c1-29-23-13-17(8-11-22(23)30-15-16-6-9-19(25)10-7-16)12-18(14-26)24-27-20-4-2-3-5-21(20)28-24/h2-13H,15H2,1H3,(H,27,28)/b18-12+
InChIKey
IPZPJCUZMDHJJE-LDADJPATSA-N
Synonyms

(2E)2(1HBENZIMIDAZOL2YL)3(4((4CHLOROBENZYL)OXY)3METHOXYPHENYL)PROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)PROP2ENENITRILE
2(1HBENZIMIDAZOL2YL)3(4((4CHLOROBENZYL)OXY)3METHOXYPHENYL)ACRYLONITRILE
COC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC4=CC=C(C=C4)Cl
COc1cc(ccc1OCc1ccc(cc1)Cl)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC24H18ClN3O2c129231317(81122(23)3015166919(25)10716)1218(1426)242720423521(20)2824h213H15H21H3(H2728)b1812+
MFCD00621094
ZINC000004149588
ZINC04149588
ZINC4149588

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Available files

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