Vitas-M small molecule compound
3,4-dihydroisoquinolin-2(1H)-yl[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone
Catalog ID
STL184269
SMILES O=C(c1cn[nH]c1c1ccc(cc1)[N+](=O)[O-])N1CCc2c(C1)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 C19H16N4O3 MW 348.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O3/c24-19(22-10-9-13-3-1-2-4-15(13)12-22)17-11-20-21-18(17)14-5-7-16(8-6-14)23(25)26/h1-8,11H,9-10,12H2,(H,20,21)InChIKey
AWZPNKGSXUPAPB-UHFFFAOYSA-NSynonyms
34dihydro1Hisoquinolin2yl(5(4nitrophenyl)1Hpyrazol4yl)methanone
34dihydroisoquinolin2(1H)yl(5(4nitrophenyl)1Hpyrazol4yl)methanone
C1CN(CC2=CC=CC=C21)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC19H16N4O3c2419(2210913312415(13)1222)1711202118(17)145716(8614)23(25)26h1811H91012H2(H2021)
MFCD22386411
O=C(c1cn(nH)c1c1ccc(cc1)(N+)(=O)(O))N1CCc2c(C1)cccc2
ZINC000072328734
ZINC72328734
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