Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-(2-butoxyphenyl)prop-2-enenitrile
Catalog ID
STK728495
SMILES CCCCOc1ccccc1/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 C20H19N3O MW 317.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O/c1-2-3-12-24-19-11-7-4-8-15(19)13-16(14-21)20-22-17-9-5-6-10-18(17)23-20/h4-11,13H,2-3,12H2,1H3,(H,22,23)/b16-13+InChIKey
PGPWUGSOVHJLIQ-DTQAZKPQSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(2butoxyphenyl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(2BUTOXYPHENYL)PROP2ENENITRILE
CCCCOC1=CC=CC=C1C=C(C#N)C2=NC3=CC=CC=C3N2
CCCCOc1ccccc1C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC20H19N3Oc1231224191174815(19)1316(1421)2022179561018(17)2320h41113H2312H21H3(H2223)b1613+
MFCD01895925
ZINC000003899511
ZINC03899511
ZINC3899511
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