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METHYL-[2-(ACRIDIN-9-YLIMINO)-3-(3-PYRIDYLCARBONYL)-4-OXOTHIAZOLIDIN-5-YLIDENE]-ACETATE
SpectraBase Compound ID 2Xk9QCPOKe1
InChI InChI=1S/C25H17N5O4S/c1-34-21(31)13-20-24(33)30(29-23(32)15-7-6-12-26-14-15)25(35-20)28-22-16-8-2-4-10-18(16)27-19-11-5-3-9-17(19)22/h2-14H,1H3,(H,29,32)/b20-13-,28-25-
InChIKey LYOYJOILXLOWKM-YUYSWHJYSA-N
Mol Weight 483.5 g/mol
Molecular Formula C25H17N5O4S
Exact Mass 483.100125 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9mUgXTfnlQ2
Name METHYL-[2-(ACRIDIN-9-YLIMINO)-3-(3-PYRIDYLCARBONYL)-4-OXOTHIAZOLIDIN-5-YLIDENE]-ACETATE
Compound Number 8G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H17N5O4S
InChI InChI=1S/C25H17N5O4S/c1-34-21(31)13-20-24(33)30(29-23(32)15-7-6-12-26-14-15)25(35-20)28-22-16-8-2-4-10-18(16)27-19-11-5-3-9-17(19)22/h2-14H,1H3,(H,29,32)/b20-13-,28-25-
InChIKey LYOYJOILXLOWKM-YUYSWHJYSA-N
Literature Reference Author J.TOMASCIKOVA,J.IMRICH,I.DANIHEL,S.BOEHM,P.KRISTIAN,J.PISARC IKOVA,M.SABOL,K.D.KL
Literature Reference Citation MOLECULES,13,501(2008)
Literature Reference DOI 10.3390/molecules13030501
Molecular Weight 483.501 g/mol
Sample ID 46401
Solvent DMSO-D6