Vitas-M small molecule compound
5-bromo-1'-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Catalog ID
STK784487
SMILES Fc1ccc(cc1)N1CCN(CC1)CN1c2ccccc2C2(C1=O)OCC(CO2)(Br)[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 C22H22BrFN4O5 MW 521.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrFN4O5/c23-21(28(30)31)13-32-22(33-14-21)18-3-1-2-4-19(18)27(20(22)29)15-25-9-11-26(12-10-25)17-7-5-16(24)6-8-17/h1-8H,9-15H2InChIKey
AIAJWHILCHVIBJ-UHFFFAOYSA-NSynonyms
5bromo1((4(4fluorophenyl)piperazin1yl)methyl)5nitrospiro(13dioxane23indol)2(1H)one
5BROMO1((4(4FLUOROPHENYL)PIPERAZIN1YL)METHYL)5NITROSPIRO(13DIOXANE23INDOLE)2ONE
C1CN(CCN1CN2C3=CC=CC=C3C4(C2=O)OCC(CO4)((N+)(=O)(O))Br)C5=CC=C(C=C5)F
Fc1ccc(cc1)N1CCN(CC1)CN1c2ccccc2C2(C1=O)OCC(CO2)(Br)(N+)(=O)(O)
InChI=1SC22H22BrFN4O5c2321(28(30)31)133222(331421)18312419(18)27(20(22)29)152591126(121025)177516(24)6817h18H915H2
MFCD06191746
ZINC000012377335
ZINC12377335
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