Vitas-M small molecule compound
(5-bromonaphthalen-1-yl)[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone
Catalog ID
STK355338
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1cccc2c1cccc2Br
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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 C22H20BrN3O4 MW 470.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O4/c1-30-15-8-9-20(21(14-15)26(28)29)24-10-12-25(13-11-24)22(27)18-6-2-5-17-16(18)4-3-7-19(17)23/h2-9,14H,10-13H2,1H3InChIKey
XYVUEWYASBGABJ-UHFFFAOYSA-NSynonyms
(5bromonaphthalen1yl)(4(4methoxy2nitrophenyl)piperazin1yl)methanone
COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC4=C3C=CC=C4Br)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C(=O)c1cccc2c1cccc2Br
InChI=1SC22H20BrN3O4c130158920(21(1415)26(28)29)24101225(131124)22(27)186251716(18)43719(17)23h2914H1013H21H3
MFCD05829280
ZINC000016215636
ZINC16215636
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