Vitas-M small molecule compound
(3-bromo-4-methoxyphenyl){4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}methanone
Catalog ID
STK028055
SMILES COc1ccc(cc1Br)C(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)[N+](=O)[O-]
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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 C21H23BrN4O4 MW 475.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN4O4/c1-30-20-7-2-14(12-17(20)22)21(27)25-10-8-24(9-11-25)16-5-6-19(26(28)29)18(13-16)23-15-3-4-15/h2,5-7,12-13,15,23H,3-4,8-11H2,1H3InChIKey
UFHFBPKSTWAWKP-UHFFFAOYSA-NSynonyms
(3BROMO4METHOXYPHENYL)(4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZIN1YL)METHANONE
3BROMO4METHOXYPHENYL4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZINYLKETONE
COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NC4CC4)Br
COc1ccc(cc1Br)C(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O)
InChI=1SC21H23BrN4O4c130207214(1217(20)22)21(27)2510824(91125)165619(26(28)29)18(1316)23153415h25712131523H34811H21H3
MFCD02627832
STK028055
ZINC000008816630
ZINC08816630
ZINC8816630
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