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6-ETHYL-7-ETHYLTHIO-3-METHYL-1,4-DIPHENYL-4,6,9-TRIHYDRO-PYRAZOLO-[5,4-B]-PYRIMIDINO-[5,4-E]-PYRIDIN-5-ONE
SpectraBase Compound ID EAQvBdOeA5w
InChI InChI=1S/C25H25N5OS/c1-4-29-24(31)21-20(17-12-8-6-9-13-17)19-16(3)28-30(18-14-10-7-11-15-18)23(19)26-22(21)27-25(29)32-5-2/h6-15,20,26H,4-5H2,1-3H3
InChIKey NRUKBIOORKKLIJ-UHFFFAOYSA-N
Mol Weight 443.57 g/mol
Molecular Formula C25H25N5OS
Exact Mass 443.177982 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JbE04iuPWBs
Name 6-ETHYL-7-ETHYLTHIO-3-METHYL-1,4-DIPHENYL-4,6,9-TRIHYDRO-PYRAZOLO-[5,4-B]-PYRIMIDINO-[5,4-E]-PYRIDIN-5-ONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H25N5OS
InChI InChI=1S/C25H25N5OS/c1-4-29-24(31)21-20(17-12-8-6-9-13-17)19-16(3)28-30(18-14-10-7-11-15-18)23(19)26-22(21)27-25(29)32-5-2/h6-15,20,26H,4-5H2,1-3H3
InChIKey NRUKBIOORKKLIJ-UHFFFAOYSA-N
Literature Reference Author T.I.EL-EMARY,S.A.A.EL-MOHSEN
Literature Reference Citation MOLECULES,17,14464(2012)
Literature Reference DOI 10.3390/molecules171214464
Molecular Weight 443.566 g/mol
Sample ID 914
Solvent DMSO-D6