Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-(5-bromo-2-propoxyphenyl)prop-2-enenitrile
Catalog ID
STL432713
SMILES CCCOc1ccc(cc1/C=C(/c1nc2c([nH]1)cccc2)\C#N)Br
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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 C19H16BrN3O MW 382.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN3O/c1-2-9-24-18-8-7-15(20)11-13(18)10-14(12-21)19-22-16-5-3-4-6-17(16)23-19/h3-8,10-11H,2,9H2,1H3,(H,22,23)/b14-10+InChIKey
NXAIUQSRTPQCDW-GXDHUFHOSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(5bromo2propoxyphenyl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(5BROMO2PROPOXYPHENYL)PROP2ENENITRILE
2(1HBENZOIMIDAZOL2YL)3(5BROMO2PROPOXYPHENYL)ACRYLONITRILE
CCCOC1=C(C=C(C=C1)Br)C=C(C#N)C2=NC3=CC=CC=C3N2
CCCOc1ccc(cc1C=C(c1nc2c((nH)1)cccc2)C#N)Br
InChI=1SC19H16BrN3Oc12924188715(20)1113(18)1014(1221)192216534617(16)2319h381011H29H21H3(H2223)b1410+
MFCD02042620
ZINC000003998226
ZINC03998226
ZINC3998226
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