Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-(3,5-dimethoxyphenyl)prop-2-enenitrile
Catalog ID
STK287658
SMILES COc1cc(OC)cc(c1)/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/c1-22-14-8-12(9-15(10-14)23-2)7-13(11-19)18-20-16-5-3-4-6-17(16)21-18/h3-10H,1-2H3,(H,20,21)/b13-7+InChIKey
ZFPDVMOQWQFAOM-NTUHNPAUSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(35dimethoxyphenyl)prop2enenitrile
(2E)2BENZIMIDAZOL2YL3(35DIMETHOXYPHENYL)PROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(35DIMETHOXYPHENYL)PROP2ENENITRILE
2(1HBENZOIMIDAZOL2YL)3(35DIMETHOXYPHENYL)ACRYLONITRILE
COC1=CC(=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OC
COc1cc(OC)cc(c1)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC18H15N3O2c12214812(915(1014)232)713(1119)182016534617(16)2118h310H12H3(H2021)b137+
MFCD03996686
ZINC000004453112
ZINC04453112
ZINC4453112
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