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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[2-(phenylmethoxy)phenyl]methylene]-2-propyl-, (6Z)-
SpectraBase Compound ID JB7F5HIWfuZ
InChI InChI=1S/C22H20N4O2S/c1-2-8-19-25-26-20(23)17(21(27)24-22(26)29-19)13-16-11-6-7-12-18(16)28-14-15-9-4-3-5-10-15/h3-7,9-13,23H,2,8,14H2,1H3/b17-13-,23-20?
InChIKey GQJQLTDUCZRIRZ-HVZAKDRGSA-N
Mol Weight 404.49 g/mol
Molecular Formula C22H20N4O2S
Exact Mass 404.130697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3efWIZUWM6e
Name (6Z)-5-azanylidene-6-[(2-phenylmethoxyphenyl)methylidene]-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20N4O2S
InChI InChI=1S/C22H20N4O2S/c1-2-8-19-25-26-20(23)17(21(27)24-22(26)29-19)13-16-11-6-7-12-18(16)28-14-15-9-4-3-5-10-15/h3-7,9-13,23H,2,8,14H2,1H3/b17-13-,23-20?
InChIKey GQJQLTDUCZRIRZ-HVZAKDRGSA-N
Molecular Weight 404.488 g/mol
SMILES N=C1\C(C(=O)N=C2N1N=C(CCC)S2)=C\c1c(OCc2ccccc2)cccc1
SPLASH splash10-0006-9200000000-e9cbe8d517988aa85555
Synonyms (6Z)-5-imino-6-[(2-phenylmethoxyphenyl)methylidene]-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6Z)-6-(2-benzoxybenzylidene)-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6Z)-6-[(2-benzyloxyphenyl)methylene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Wiley ID 1453352