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5-(4-Methylsulfonyl-1-piperazinyl)-2-nitro-N-(4-phenylbutan-2-yl)aniline
SpectraBase Compound ID 6FymDt7mHgJ
InChI InChI=1S/C21H28N4O4S/c1-17(8-9-18-6-4-3-5-7-18)22-20-16-19(10-11-21(20)25(26)27)23-12-14-24(15-13-23)30(2,28)29/h3-7,10-11,16-17,22H,8-9,12-15H2,1-2H3
InChIKey MYHATGYCPPREHL-UHFFFAOYSA-N
Mol Weight 432.54 g/mol
Molecular Formula C21H28N4O4S
Exact Mass 432.183127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CyjuUTsd0B0
Name 5-(4-Methylsulfonyl-1-piperazinyl)-2-nitro-N-(4-phenylbutan-2-yl)aniline
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Formula C21H28N4O4S
InChI InChI=1S/C21H28N4O4S/c1-17(8-9-18-6-4-3-5-7-18)22-20-16-19(10-11-21(20)25(26)27)23-12-14-24(15-13-23)30(2,28)29/h3-7,10-11,16-17,22H,8-9,12-15H2,1-2H3
InChIKey MYHATGYCPPREHL-UHFFFAOYSA-N
Molecular Weight 432.539 g/mol
SMILES N(c1cc(N2CCN(S(=O)(=O)C)CC2)ccc1N(=O)=O)C(CCc1ccccc1)C
SPLASH splash10-0a6u-9534100000-b5fd7c7ee3a8f810907f
Synonyms 5-(4-Methylsulfonylpiperazin-1-yl)-2-nitro-N-(4-phenylbutan-2-yl)aniline N-(1-methyl-3-phenyl-propyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitro-aniline [5-(4-mesylpiperazino)-2-nitro-phenyl]-(1-methyl-3-phenyl-propyl)amine
Wiley ID 1455089