Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxy-3-nitrophenyl)prop-2-enenitrile
Catalog ID
STK708148
SMILES N#C/C(=C\c1ccc(c(c1)[N+](=O)[O-])OC)/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 C17H12N4O3 MW 320.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N4O3/c1-24-16-7-6-11(9-15(16)21(22)23)8-12(10-18)17-19-13-4-2-3-5-14(13)20-17/h2-9H,1H3,(H,19,20)/b12-8+InChIKey
OVZMHUNCNQETLG-XYOKQWHBSA-NSynonyms
374097-10-6(2E)2(1Hbenzimidazol2yl)3(4methoxy3nitrophenyl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(4METHOXY3NITROPHENYL)PROP2ENENITRILE
(E)2(1Hbenzo(d)imidazol2yl)3(4methoxy3nitrophenyl)acrylonitrile
374097106
COC1=C(C=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)(N+)(=O)(O)
InChI=1SC17H12N4O3c124167611(915(16)21(22)23)812(1018)171913423514(13)2017h29H1H3(H1920)b128+
MFCD01951909
N#CC(=Cc1ccc(c(c1)(N+)(=O)(O))OC)c1nc2c((nH)1)cccc2
ZINC000004808809
ZINC04808809
ZINC4808809
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