Vitas-M small molecule compound
(E)-1-(4-nitrophenyl)-2-[1-(prop-2-en-1-yl)-1H-benzimidazol-2-yl]ethenyl 4-nitrobenzoate
Catalog ID
STK697991
SMILES C=CCn1c(/C=C(\c2ccc(cc2)[N+](=O)[O-])/OC(=O)c2ccc(cc2)[N+](=O)[O-])nc2c1cccc2
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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 C25H18N4O6 MW 470.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N4O6/c1-2-15-27-22-6-4-3-5-21(22)26-24(27)16-23(17-7-11-19(12-8-17)28(31)32)35-25(30)18-9-13-20(14-10-18)29(33)34/h2-14,16H,1,15H2/b23-16+InChIKey
KZXVWCYJWMZFBK-XQNSMLJCSA-NSynonyms
((E)1(4NITROPHENYL)2(1PROP2ENYLBENZIMIDAZOL2YL)ETHENYL)4NITROBENZOATE
(E)1(4nitrophenyl)2(1(prop2en1yl)1Hbenzimidazol2yl)ethenyl4nitrobenzoate
(E)2(1allyl1Hbenzo(d)imidazol2yl)1(4nitrophenyl)vinyl4nitrobenzoate
C=CCn1c(C=C(c2ccc(cc2)(N+)(=O)(O))OC(=O)c2ccc(cc2)(N+)(=O)(O))nc2c1cccc2
C=CCN1C2=CC=CC=C2N=C1C=C(C3=CC=C(C=C3)(N+)(=O)(O))OC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC25H18N4O6c12152722643521(22)2624(27)1623(1771119(12817)28(31)32)3525(30)1891320(141018)29(33)34h21416H115H2b2316+
MFCD02992975
ZINC000009273772
ZINC09273772
ZINC9273772
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