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Methyl 2,5-Dihydro-2-phenyl-5-(1-phenyl-p-toluenesulfonamidomethyl)-1-tosylpyrrole-3-carboxylate
SpectraBase Compound ID E3ZBeaxKvE5
InChI InChI=1S/C33H32N2O6S2/c1-23-14-18-27(19-15-23)42(37,38)34-31(25-10-6-4-7-11-25)30-22-29(33(36)41-3)32(26-12-8-5-9-13-26)35(30)43(39,40)28-20-16-24(2)17-21-28/h4-22,30-32,34H,1-3H3/t30-,31?,32-/m0/s1
InChIKey KXAISPLDBKRBCM-GFMLHKOCSA-N
Mol Weight 616.7 g/mol
Molecular Formula C33H32N2O6S2
Exact Mass 616.170179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EiNOa06LGvr
Name Methyl 2,5-Dihydro-2-phenyl-5-(1-phenyl-p-toluenesulfonamidomethyl)-1-tosylpyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H32N2O6S2
InChI InChI=1S/C33H32N2O6S2/c1-23-14-18-27(19-15-23)42(37,38)34-31(25-10-6-4-7-11-25)30-22-29(33(36)41-3)32(26-12-8-5-9-13-26)35(30)43(39,40)28-20-16-24(2)17-21-28/h4-22,30-32,34H,1-3H3/t30-,31?,32-/m0/s1
InChIKey KXAISPLDBKRBCM-GFMLHKOCSA-N
Molecular Weight 616.747 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C([C@]1(N(S(c2ccc(cc2)C)(=O)=O)[C@](C(C(=O)OC)=C1)(c1ccccc1)[H])[H])c1ccccc1
SPLASH splash10-01ox-9060000000-b73de31daf281fbadb3d
Source of Spectrum J-63-5039-10
Synonyms (1R,2S,5S)-2-Phenyl-5-[phenyl-(toluene-4-sulfonylamino)-methyl]-1-(toluene-4-sulfonyl)-2,5-dihydro-1H-pyrrole-3-carboxylic acid methyl ester Methyl 1-[(4-methylphenyl)sulfonyl]-5-[{[(4-methylphenyl)sulfonyl]amino}(phenyl)methyl]-2-phenyl-2,5-dihydro-1H-pyrrole-3-carboxylate
Wiley ID 1411315