Vitas-M small molecule compound

5-bromo-5-nitro-1'-[(4-phenylpiperazin-1-yl)methyl]spiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one

Catalog ID
STK663730
SMILES O=C1N(CN2CCN(CC2)c2ccccc2)c2c(C31OCC(CO3)(Br)[N+](=O)[O-])cccc2

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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 C22H23BrN4O5 MW 503.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN4O5/c23-21(27(29)30)14-31-22(32-15-21)18-8-4-5-9-19(18)26(20(22)28)16-24-10-12-25(13-11-24)17-6-2-1-3-7-17/h1-9H,10-16H2
InChIKey
RSKLQZMUMPYPAX-UHFFFAOYSA-N
Synonyms
5bromo5nitro1((4phenylpiperazin1yl)methyl)spiro(13dioxane23indol)2(1H)one
5BROMO5NITRO1((4PHENYLPIPERAZIN1YL)METHYL)SPIRO(13DIOXANE23INDOLE)2ONE
C1CN(CCN1CN2C3=CC=CC=C3C4(C2=O)OCC(CO4)((N+)(=O)(O))Br)C5=CC=CC=C5
O=C1N(CN2CCN(CC2)c2ccccc2)c2c(C31OCC(CO3)(Br)(N+)(=O)(O))cccc2
Registry IDs
MFCD03942012
ZINC000012376696
ZINC12376696

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Available files

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