Vitas-M small molecule compound

(2E)-2-(1H-benzimidazol-2-yl)-3-(3,4-dimethoxyphenyl)prop-2-enenitrile

Catalog ID
STK096605
SMILES COc1cc(ccc1OC)/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 C18H15N3O2 MW 305.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O2/c1-22-16-8-7-12(10-17(16)23-2)9-13(11-19)18-20-14-5-3-4-6-15(14)21-18/h3-10H,1-2H3,(H,20,21)/b13-9+
InChIKey
SIPOTHFKLAFEAC-UKTHLTGXSA-N
Synonyms
1001430-35-8
(2E)2(1HBENZIMIDAZOL2YL)3(34DIMETHOXYPHENYL)PROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(34DIMETHOXYPHENYL)PROP2ENENITRILE
(E)2(1Hbenzo(d)imidazol2yl)3(34dimethoxyphenyl)acrylonitrile
1001430358
2(1HBENZOIMIDAZOL2YL)3(34DIMETHOXYPHENYL)ACRYLONITRILE
3(34DIMETHOXYPHENYL)2(1HBENZOIMIDAZOLE2YL)PROPENENITRILE
COC1=C(C=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OC
COc1cc(ccc1OC)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC18H15N3O2c122168712(1017(16)232)913(1119)182014534615(14)2118h310H12H3(H2021)b139+
MFCD00392762
STK096605
ZINC000012367931
ZINC12367931

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Available files

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