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2-THIONE-3(N)-[(3'-AMINO)-9'-ACRIDINYL]-5-DIETHYLAMINOETHYLTHIO-1,3,4-THIADIAZOLE

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2-THIONE-3(N)-[(3'-AMINO)-9'-ACRIDINYL]-5-DIETHYLAMINOETHYLTHIO-1,3,4-THIADIAZOLE
SpectraBase Compound ID EO7YVmDhKKw
InChI InChI=1S/C21H23N5S3/c1-3-25(4-2)11-12-28-20-24-26(21(27)29-20)19-15-7-5-6-8-17(15)23-18-13-14(22)9-10-16(18)19/h5-10,13H,3-4,11-12,22H2,1-2H3
InChIKey KMGATDOMMKKINZ-UHFFFAOYSA-N
Mol Weight 441.63 g/mol
Molecular Formula C21H23N5S3
Exact Mass 441.111559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7W4cFEFLQAO
Name 2-THIONE-3(N)-[(3'-AMINO)-9'-ACRIDINYL]-5-DIETHYLAMINOETHYLTHIO-1,3,4-THIADIAZOLE
Compound Number 7K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23N5S3
InChI InChI=1S/C21H23N5S3/c1-3-25(4-2)11-12-28-20-24-26(21(27)29-20)19-15-7-5-6-8-17(15)23-18-13-14(22)9-10-16(18)19/h5-10,13H,3-4,11-12,22H2,1-2H3
InChIKey KMGATDOMMKKINZ-UHFFFAOYSA-N
Literature Reference Author P.AMIEL,A.MAHAMOUD,P.BROUANT,J.P.GALY,J.BARBE,J.KAROLAK-WOJC IECHOWSKA,M.POSEL
Literature Reference Citation CAN.J.CHEM.,73,1258(1995)
Literature Reference DOI 10.1139/v95-154
Molecular Weight 441.627 g/mol
Solvent CDCl3
Source File Reference UWRK993