Vitas-M small molecule compound
(5-bromo-2-chlorophenyl)[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone
Catalog ID
STK355356
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1cc(Br)ccc1Cl
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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 C18H17BrClN3O4 MW 454.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrClN3O4/c1-27-13-3-5-16(17(11-13)23(25)26)21-6-8-22(9-7-21)18(24)14-10-12(19)2-4-15(14)20/h2-5,10-11H,6-9H2,1H3InChIKey
VRRDSBXRXVYENW-UHFFFAOYSA-NSynonyms
(5bromo2chlorophenyl)(4(4methoxy2nitrophenyl)piperazin1yl)methanone
COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Br)Cl)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C(=O)c1cc(Br)ccc1Cl
InChI=1SC18H17BrClN3O4c127133516(17(1113)23(25)26)216822(9721)18(24)141012(19)2415(14)20h251011H69H21H3
MFCD05829352
ZINC000016215619
ZINC16215619
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