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N,N-Dibenzyl-4-[1-(4-methoxyphenyl)-2-methylthioimidazol-5-yl]benzene sulfonamide

View entire compound with spectra: 1 MS (GC)

N,N-Dibenzyl-4-[1-(4-methoxyphenyl)-2-methylthioimidazol-5-yl]benzene sulfonamide
SpectraBase Compound ID Er99nAqthV0
InChI InChI=1S/C31H29N3O3S2/c1-37-28-17-15-27(16-18-28)34-30(21-32-31(34)38-2)26-13-19-29(20-14-26)39(35,36)33(22-24-9-5-3-6-10-24)23-25-11-7-4-8-12-25/h3-21H,22-23H2,1-2H3
InChIKey DDMWYHBYLPGTDJ-UHFFFAOYSA-N
Mol Weight 555.71 g/mol
Molecular Formula C31H29N3O3S2
Exact Mass 555.165034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqYntlMS4VR
Name N,N-Dibenzyl-4-[1-(4-methoxyphenyl)-2-methylthioimidazol-5-yl]benzene sulfonamide
Alternate Name(s) N,N-dibenzyl-4-(1-(4-methoxyphenyl)-2-(methylthio)-1H-imidazol-5-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H29N3O3S2
InChI InChI=1S/C31H29N3O3S2/c1-37-28-17-15-27(16-18-28)34-30(21-32-31(34)38-2)26-13-19-29(20-14-26)39(35,36)33(22-24-9-5-3-6-10-24)23-25-11-7-4-8-12-25/h3-21H,22-23H2,1-2H3
InChIKey DDMWYHBYLPGTDJ-UHFFFAOYSA-N
Molecular Weight 555.711 g/mol
SMILES C(N(S(c1ccc(-c2[n](c(SC)nc2)-c2ccc(cc2)OC)cc1)(=O)=O)Cc1ccccc1)c1ccccc1
SPLASH splash10-0a4i-1000090000-d870c05d9709e91854cd
Source of Spectrum Y-51-77-7k
Wiley ID 1741168