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N-[2,2-DICHLORO-1-[(5-CHLORO-PYRIMIDIN-2-YL)-AMINO]-2-PHENYL-ETHYL]-4-METHYL-BENZENESULFONAMIDE
SpectraBase Compound ID LmCWJaMxW3F
InChI InChI=1S/C19H17Cl3N4O2S/c1-13-7-9-16(10-8-13)29(27,28)26-17(25-18-23-11-15(20)12-24-18)19(21,22)14-5-3-2-4-6-14/h2-12,17,26H,1H3,(H,23,24,25)
InChIKey VXICOWIMWJKZBW-UHFFFAOYSA-N
Mol Weight 471.79 g/mol
Molecular Formula C19H17Cl3N4O2S
Exact Mass 470.01378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ej5i13NjKlG
Name N-[2,2-DICHLORO-1-[(5-CHLORO-PYRIMIDIN-2-YL)-AMINO]-2-PHENYL-ETHYL]-4-METHYL-BENZENESULFONAMIDE
Compound Number 8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H17Cl3N4O2S
InChI InChI=1S/C19H17Cl3N4O2S/c1-13-7-9-16(10-8-13)29(27,28)26-17(25-18-23-11-15(20)12-24-18)19(21,22)14-5-3-2-4-6-14/h2-12,17,26H,1H3,(H,23,24,25)
InChIKey VXICOWIMWJKZBW-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 471.789 g/mol
Solvent DMSO-D6
Source File Reference UWIR18886