Vitas-M small molecule compound

(2E)-2-(1H-benzimidazol-2-yl)-3-[2-(2-methylpropoxy)phenyl]prop-2-enenitrile

Catalog ID
STL364573
SMILES N#C/C(=C\c1ccccc1OCC(C)C)/c1nc2c([nH]1)cccc2

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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/c1-14(2)13-24-19-10-6-3-7-15(19)11-16(12-21)20-22-17-8-4-5-9-18(17)23-20/h3-11,14H,13H2,1-2H3,(H,22,23)/b16-11+
InChIKey
GBRUWQXPAHIDSS-LFIBNONCSA-N
Synonyms

(2E)2(1Hbenzimidazol2yl)3(2(2methylpropoxy)phenyl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(2(2METHYLPROPOXY)PHENYL)PROP2ENENITRILE
CC(C)COC1=CC=CC=C1C=C(C#N)C2=NC3=CC=CC=C3N2
InChI=1SC20H19N3Oc114(2)1324191063715(19)1116(1221)202217845918(17)2320h31114H13H212H3(H2223)b1611+
MFCD06636593
N#CC(=Cc1ccccc1OCC(C)C)c1nc2c((nH)1)cccc2
ZINC000004843162
ZINC04843162
ZINC4843162

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Available files

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