Vitas-M small molecule compound
(2Z)-2-(5-methoxy-1H-benzimidazol-2-yl)-3-[4-(morpholin-4-yl)phenyl]prop-2-enenitrile
Catalog ID
STK201879
SMILES N#C/C(=C/c1ccc(cc1)N1CCOCC1)/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 C21H20N4O2 MW 360.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2/c1-26-18-6-7-19-20(13-18)24-21(23-19)16(14-22)12-15-2-4-17(5-3-15)25-8-10-27-11-9-25/h2-7,12-13H,8-11H2,1H3,(H,23,24)/b16-12-InChIKey
HGTMKZQLHIJQAR-VBKFSLOCSA-NSynonyms
(2Z)2(5METHOXY1HBENZIMIDAZOL2YL)3(4(MORPHOLIN4YL)PHENYL)PROP2ENENITRILE
(Z)2(6METHOXY1HBENZIMIDAZOL2YL)3(4MORPHOLIN4YLPHENYL)PROP2ENENITRILE
COC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(C=C3)N4CCOCC4)C#N
InChI=1SC21H20N4O2c12618671920(1318)2421(2319)16(1422)12152417(5315)258102711925h271213H811H21H3(H2324)b1612
MFCD06002078
N#CC(=Cc1ccc(cc1)N1CCOCC1)c1nc2c((nH)1)ccc(c2)OC
ZINC000004739923
ZINC04739923
ZINC4739923
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