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N-[2,2-DICHLORO-1-[(4-METHYLPYRIMIDIN-2-YL)-AMINO]-2-PHENYL-ETHYL]-4-METHYL-BENZENESULFONAMIDE
SpectraBase Compound ID 1We4PqVLSEo
InChI InChI=1S/C20H20Cl2N4O2S/c1-14-8-10-17(11-9-14)29(27,28)26-18(25-19-23-13-12-15(2)24-19)20(21,22)16-6-4-3-5-7-16/h3-13,18,26H,1-2H3,(H,23,24,25)
InChIKey CJIBOQPPEWFUFY-UHFFFAOYSA-N
Mol Weight 451.37 g/mol
Molecular Formula C20H20Cl2N4O2S
Exact Mass 450.068402 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8YMONaFZptb
Name N-[2,2-DICHLORO-1-[(4-METHYLPYRIMIDIN-2-YL)-AMINO]-2-PHENYL-ETHYL]-4-METHYL-BENZENESULFONAMIDE
Compound Number 4 C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20Cl2N4O2S
InChI InChI=1S/C20H20Cl2N4O2S/c1-14-8-10-17(11-9-14)29(27,28)26-18(25-19-23-13-12-15(2)24-19)20(21,22)16-6-4-3-5-7-16/h3-13,18,26H,1-2H3,(H,23,24,25)
InChIKey CJIBOQPPEWFUFY-UHFFFAOYSA-N
Literature Reference Author I.B.ROZENTSVEIG,V.Y.SERYKH,G.N.CHERNYSHEVA,E.V.KONDRASHOV,A. I.FEDOTOVA,I.A.USHAK
Literature Reference Citation EUR.J.ORG.CHEM.,2014,6547(2014)
Literature Reference DOI 10.1002/ejoc.201402695
Molecular Weight 451.370 g/mol
Solvent DMSO-D6
Source File Reference UWIR18874