Vitas-M small molecule compound
(5-bromo-2-methoxy-3-methylphenyl)[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone
Catalog ID
STK355502
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1cc(Br)cc(c1OC)C
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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 C20H22BrN3O5 MW 464.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrN3O5/c1-13-10-14(21)11-16(19(13)29-3)20(25)23-8-6-22(7-9-23)17-5-4-15(28-2)12-18(17)24(26)27/h4-5,10-12H,6-9H2,1-3H3InChIKey
BVOJZFBJRFONEA-UHFFFAOYSA-NSynonyms
(5bromo2methoxy3methylphenyl)(4(4methoxy2nitrophenyl)piperazin1yl)methanone
5BROMO2METHOXY3METHYLPHENYL4(4METHOXY2NITROPHENYL)PIPERAZINYLKETONE
CC1=C(C(=CC(=C1)Br)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)OC)(N+)(=O)(O))OC
COc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C(=O)c1cc(Br)cc(c1OC)C
InChI=1SC20H22BrN3O5c1131014(21)1116(19(13)293)20(25)238622(7923)175415(282)1218(17)24(26)27h451012H69H213H3
MFCD05661818
ZINC000004125210
ZINC04125210
ZINC4125210
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