Vitas-M small molecule compound
(2Z)-2-(1H-benzimidazol-2-yl)-3-[4-(benzyloxy)-3-chloro-5-methoxyphenyl]prop-2-enenitrile
Catalog ID
STK287693
SMILES COc1cc(cc(c1OCc1ccccc1)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/c1-29-22-13-17(12-19(25)23(22)30-15-16-7-3-2-4-8-16)11-18(14-26)24-27-20-9-5-6-10-21(20)28-24/h2-13H,15H2,1H3,(H,27,28)/b18-11-InChIKey
CVCIIJKTSUJCFN-WQRHYEAKSA-NSynonyms
(2Z)2(1Hbenzimidazol2yl)3(4(benzyloxy)3chloro5methoxyphenyl)prop2enenitrile
(Z)2(1HBENZIMIDAZOL2YL)3(3CHLORO5METHOXY4PHENYLMETHOXYPHENYL)PROP2ENENITRILE
COC1=C(C(=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)Cl)OCC4=CC=CC=C4
COc1cc(cc(c1OCc1ccccc1)Cl)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC24H18ClN3O2c129221317(1219(25)23(22)3015167324816)1118(1426)2427209561021(20)2824h213H15H21H3(H2728)b1811
MFCD04212443
ZINC000004978867
ZINC04978867
ZINC4978867
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