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N,N-Dibenzyl-4-[2-ethylthio-1-(4-fluorophenyl)imidazol-5-yl]benzene sulfonamide
SpectraBase Compound ID 4WQVU2lUoSU
InChI InChI=1S/C31H28FN3O2S2/c1-2-38-31-33-21-30(35(31)28-17-15-27(32)16-18-28)26-13-19-29(20-14-26)39(36,37)34(22-24-9-5-3-6-10-24)23-25-11-7-4-8-12-25/h3-21H,2,22-23H2,1H3
InChIKey WFRKTULDFAOLOL-UHFFFAOYSA-N
Mol Weight 557.7 g/mol
Molecular Formula C31H28FN3O2S2
Exact Mass 557.160698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BR6o89Vl4Tt
Name N,N-Dibenzyl-4-[2-ethylthio-1-(4-fluorophenyl)imidazol-5-yl]benzene sulfonamide
Alternate Name(s) N,N-dibenzyl-4-(2-(ethylthio)-1-(4-fluorophenyl)-1H-imidazol-5-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H28FN3O2S2
InChI InChI=1S/C31H28FN3O2S2/c1-2-38-31-33-21-30(35(31)28-17-15-27(32)16-18-28)26-13-19-29(20-14-26)39(36,37)34(22-24-9-5-3-6-10-24)23-25-11-7-4-8-12-25/h3-21H,2,22-23H2,1H3
InChIKey WFRKTULDFAOLOL-UHFFFAOYSA-N
Molecular Weight 557.702 g/mol
SMILES C(N(S(c1ccc(-c2[n](c(SCC)nc2)-c2ccc(cc2)F)cc1)(=O)=O)Cc1ccccc1)c1ccccc1
SPLASH splash10-0abc-7430190000-7c147702ce5ef7b61047
Source of Spectrum Y-51-75-7f
Wiley ID 1741173