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N,N-Dibenzyl-4-[1-(4-chlorophenyl)-2-methylthioimidazol-5-yl]benzene sulfonamide
SpectraBase Compound ID 6HXgZMOcRT6
InChI InChI=1S/C30H26ClN3O2S2/c1-37-30-32-20-29(34(30)27-16-14-26(31)15-17-27)25-12-18-28(19-13-25)38(35,36)33(21-23-8-4-2-5-9-23)22-24-10-6-3-7-11-24/h2-20H,21-22H2,1H3
InChIKey KBPOQQBOFDYLOY-UHFFFAOYSA-N
Mol Weight 560.13 g/mol
Molecular Formula C30H26ClN3O2S2
Exact Mass 559.115497 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PMHq2zO9nJ
Name N,N-Dibenzyl-4-[1-(4-chlorophenyl)-2-methylthioimidazol-5-yl]benzene sulfonamide
Alternate Name(s) N,N-dibenzyl-4-(1-(4-chlorophenyl)-2-(methylthio)-1H-imidazol-5-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H26ClN3O2S2
InChI InChI=1S/C30H26ClN3O2S2/c1-37-30-32-20-29(34(30)27-16-14-26(31)15-17-27)25-12-18-28(19-13-25)38(35,36)33(21-23-8-4-2-5-9-23)22-24-10-6-3-7-11-24/h2-20H,21-22H2,1H3
InChIKey KBPOQQBOFDYLOY-UHFFFAOYSA-N
Molecular Weight 560.130 g/mol
SMILES C(N(S(c1ccc(-c2[n](c(SC)nc2)-c2ccc(cc2)Cl)cc1)(=O)=O)Cc1ccccc1)c1ccccc1
SPLASH splash10-0bt9-1000090000-8ae677b9c71d9b0ed8af
Source of Spectrum Y-51-76-7g
Wiley ID 1741172