Vitas-M small molecule compound
1-benzofuran-2-yl[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone
Catalog ID
STK355470
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1cc2c(o1)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 C20H19N3O5 MW 381.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O5/c1-27-15-6-7-16(17(13-15)23(25)26)21-8-10-22(11-9-21)20(24)19-12-14-4-2-3-5-18(14)28-19/h2-7,12-13H,8-11H2,1H3InChIKey
LQDLYEDCXNWHCN-UHFFFAOYSA-NSynonyms
1benzofuran2yl(4(4methoxy2nitrophenyl)piperazin1yl)methanone
COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4O3)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C(=O)c1cc2c(o1)cccc2
InChI=1SC20H19N3O5c127156716(17(1315)23(25)26)2181022(11921)20(24)191214423518(14)2819h271213H811H21H3
MFCD05661815
ZINC000004125191
ZINC04125191
ZINC4125191
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