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6-[[2-(DIETHYLAMINO)-ETHYL]-THIO]-3-PHENYL-2H-[1,2,4]-TRIAZINO-[2,3-C]-QUINAZOLIN-2-ONE
SpectraBase Compound ID IsbSHK4qOAr
InChI InChI=1S/C22H23N5OS/c1-3-26(4-2)14-15-29-22-23-18-13-9-8-12-17(18)20-24-21(28)19(25-27(20)22)16-10-6-5-7-11-16/h5-13H,3-4,14-15H2,1-2H3
InChIKey SNNMPTXYBYFXNC-UHFFFAOYSA-N
Mol Weight 405.52 g/mol
Molecular Formula C22H23N5OS
Exact Mass 405.162332 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IagmWcRzCoI
Name 6-[[2-(DIETHYLAMINO)-ETHYL]-THIO]-3-PHENYL-2H-[1,2,4]-TRIAZINO-[2,3-C]-QUINAZOLIN-2-ONE
Compound Number 3.16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H23N5OS
InChI InChI=1S/C22H23N5OS/c1-3-26(4-2)14-15-29-22-23-18-13-9-8-12-17(18)20-24-21(28)19(25-27(20)22)16-10-6-5-7-11-16/h5-13H,3-4,14-15H2,1-2H3
InChIKey SNNMPTXYBYFXNC-UHFFFAOYSA-N
Literature Reference Author G.G.BEREST,O.Y.VOSKOBOYNIK,S.I.KOVALENKO,I.S.NOSULENKO,L.M.A NTYPENKO,O.M.ANTYPEN
Literature Reference Citation SCI.PHARM.,80,37(2012)
Molecular Weight 405.518 g/mol
Sample ID 73504
Solvent DMSO-D6