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3-[[5-(2-CHLORO-PHENYL)-1,3,4-OXADIAZOL-2-YL]-METHYL]-2-[2-[(2,6-DICHLORO-PHENYL)-AMINO]-BENZYL]-QUINAZOLIN-4(3H)-ONE

View entire compound with spectra: 1 NMR

3-[[5-(2-CHLORO-PHENYL)-1,3,4-OXADIAZOL-2-YL]-METHYL]-2-[2-[(2,6-DICHLORO-PHENYL)-AMINO]-BENZYL]-QUINAZOLIN-4(3H)-ONE
SpectraBase Compound ID 26MzbOgS2ye
InChI InChI=1S/C30H20Cl3N5O2/c31-21-11-4-2-9-19(21)29-37-36-27(40-29)17-38-26(34-25-15-6-3-10-20(25)30(38)39)16-18-8-1-5-14-24(18)35-28-22(32)12-7-13-23(28)33/h1-15,35H,16-17H2
InChIKey CVMANAFXNQCJRL-UHFFFAOYSA-N
Mol Weight 588.88 g/mol
Molecular Formula C30H20Cl3N5O2
Exact Mass 587.068258 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DOQCryIfXP4
Name 3-[[5-(2-CHLORO-PHENYL)-1,3,4-OXADIAZOL-2-YL]-METHYL]-2-[2-[(2,6-DICHLORO-PHENYL)-AMINO]-BENZYL]-QUINAZOLIN-4(3H)-ONE
Compound Number 12A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H20Cl3N5O2
InChI InChI=1S/C30H20Cl3N5O2/c31-21-11-4-2-9-19(21)29-37-36-27(40-29)17-38-26(34-25-15-6-3-10-20(25)30(38)39)16-18-8-1-5-14-24(18)35-28-22(32)12-7-13-23(28)33/h1-15,35H,16-17H2
InChIKey CVMANAFXNQCJRL-UHFFFAOYSA-N
Literature Reference Author N.B.PATEL,J.C.PATEL
Literature Reference Citation SCI.PHARM.,78,171(2010)
Literature Reference DOI 10.3797/scipharm.0912-16
Molecular Weight 588.880 g/mol
Sample ID 3010
Solvent DMSO-D6