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1-[[4-[2-(5-CHLORO-2-METHOXYBENZAMIDO)-ETHYL]-PHENYL]-SULFONYL]-3-(3-HYDROXYPROPYL)-UREA

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1-[[4-[2-(5-CHLORO-2-METHOXYBENZAMIDO)-ETHYL]-PHENYL]-SULFONYL]-3-(3-HYDROXYPROPYL)-UREA
SpectraBase Compound ID JCf9r1MhB5f
InChI InChI=1S/C20H24ClN3O6S/c1-30-18-8-5-15(21)13-17(18)19(26)22-11-9-14-3-6-16(7-4-14)31(28,29)24-20(27)23-10-2-12-25/h3-8,13,25H,2,9-12H2,1H3,(H,22,26)(H2,23,24,27)
InChIKey ZMKPMVUOKFKKOX-UHFFFAOYSA-N
Mol Weight 469.94 g/mol
Molecular Formula C20H24ClN3O6S
Exact Mass 469.107434 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID En81kbsJFV1
Name 1-[[4-[2-(5-CHLORO-2-METHOXYBENZAMIDO)-ETHYL]-PHENYL]-SULFONYL]-3-(3-HYDROXYPROPYL)-UREA
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24ClN3O6S
InChI InChI=1S/C20H24ClN3O6S/c1-30-18-8-5-15(21)13-17(18)19(26)22-11-9-14-3-6-16(7-4-14)31(28,29)24-20(27)23-10-2-12-25/h3-8,13,25H,2,9-12H2,1H3,(H,22,26)(H2,23,24,27)
InChIKey ZMKPMVUOKFKKOX-UHFFFAOYSA-N
Literature Reference Author R.A.HILL,S.RUDRA,B.PENG,D.S.ROANE,J.K.BOUNDS,Y.ZHANG,A.ADLOO ,T.LU
Literature Reference Citation BIOORG.MED.CHEM.,11,2099(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00606-5
Molecular Weight 469.940 g/mol
Sample ID 29268
Solvent DMSO-D6