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N-[2-(2-CHLOROPHENYL)-1-[6,8-DIBROMO-3-(4,6-DIOXO-3-PHENYL-2-THIOXOTETRAHYDROPYRIMIDIN-1-YL)-4-OXO-3,4-DIHYDRO-QUINAZOLIN-2-YL]-VINYL]-BENZAMIDE
SpectraBase Compound ID GXVG6t8cihG
InChI InChI=1S/C33H20Br2ClN5O4S/c34-21-16-23-29(24(35)17-21)38-30(26(15-20-11-7-8-14-25(20)36)37-31(44)19-9-3-1-4-10-19)41(32(23)45)40-28(43)18-27(42)39(33(40)46)22-12-5-2-6-13-22/h1-17H,18H2,(H,37,44)/b26-15-
InChIKey BOYBVZFFOSHMMT-YSMPRRRNSA-N
Mol Weight 777.9 g/mol
Molecular Formula C33H20Br2ClN5O4S
Exact Mass 774.929129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Fhow3ddvfZ
Name N-[2-(2-CHLOROPHENYL)-1-[6,8-DIBROMO-3-(4,6-DIOXO-3-PHENYL-2-THIOXOTETRAHYDROPYRIMIDIN-1-YL)-4-OXO-3,4-DIHYDRO-QUINAZOLIN-2-YL]-VINYL]-BENZAMIDE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H20Br2ClN5O4S
InChI InChI=1S/C33H20Br2ClN5O4S/c34-21-16-23-29(24(35)17-21)38-30(26(15-20-11-7-8-14-25(20)36)37-31(44)19-9-3-1-4-10-19)41(32(23)45)40-28(43)18-27(42)39(33(40)46)22-12-5-2-6-13-22/h1-17H,18H2,(H,37,44)/b26-15-
InChIKey BOYBVZFFOSHMMT-YSMPRRRNSA-N
Literature Reference Author T.M.ABDEL-RAHMAN
Literature Reference Citation J.HETCYCL.CHEM.,43,527(2006)
Literature Reference DOI 10.1002/jhet.5570430302
Molecular Weight 777.874 g/mol
Sample ID 41747
Solvent DMSO-D6