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5-[3-(4-fluoro-phenyl)-1-(toluene-4-sulfonyl)-1H-pyrazol-4-yl]-2-(toluene-4-sulfonyl)-1,2,3,5,6,10b-hexahydro-imidazo[5,1-a]isoquinoline

View entire compound with spectra: 1 MS (GC)

5-[3-(4-fluoro-phenyl)-1-(toluene-4-sulfonyl)-1H-pyrazol-4-yl]-2-(toluene-4-sulfonyl)-1,2,3,5,6,10b-hexahydro-imidazo[5,1-a]isoquinoline
SpectraBase Compound ID 4ONK6P8mcNs
InChI InChI=1S/C34H31FN4O4S2/c1-23-7-15-28(16-8-23)44(40,41)37-21-33-30-6-4-3-5-26(30)19-32(38(33)22-37)31-20-39(36-34(31)25-11-13-27(35)14-12-25)45(42,43)29-17-9-24(2)10-18-29/h3-18,20,32-33H,19,21-22H2,1-2H3
InChIKey OGLOXVCIVUVLFR-UHFFFAOYSA-N
Mol Weight 642.8 g/mol
Molecular Formula C34H31FN4O4S2
Exact Mass 642.177076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZCsSmmrUCu
Name 5-[3-(4-fluoro-phenyl)-1-(toluene-4-sulfonyl)-1H-pyrazol-4-yl]-2-(toluene-4-sulfonyl)-1,2,3,5,6,10b-hexahydro-imidazo[5,1-a]isoquinoline
Alternate Name(s) 5-{3-(4-fluorophenyl)-1-[(4-methylphenyl)sulfonyl]-1H-pyrazol-4-yl}-2-[(4-methylphenyl)sulfonyl]-1,2,3,5,6,10b-hexahydroimidazo[5,1-a]isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H31FN4O4S2
InChI InChI=1S/C34H31FN4O4S2/c1-23-7-15-28(16-8-23)44(40,41)37-21-33-30-6-4-3-5-26(30)19-32(38(33)22-37)31-20-39(36-34(31)25-11-13-27(35)14-12-25)45(42,43)29-17-9-24(2)10-18-29/h3-18,20,32-33H,19,21-22H2,1-2H3
InChIKey OGLOXVCIVUVLFR-UHFFFAOYSA-N
Molecular Weight 642.764 g/mol
SMILES c1ccc2c(CC(N3C2CN(C3)S(c2ccc(cc2)C)(=O)=O)c2c[n](S(c3ccc(cc3)C)(=O)=O)nc2-c2ccc(cc2)F)c1
SPLASH splash10-0a4l-3912200000-360ff9827ce5544b1b7f
Wiley ID 1464225