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(5E)-1-phenyl-5-[[(2-pyridin-3-ylpiperidin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
SpectraBase Compound ID 62TDMaOdoYn
InChI InChI=1S/C21H21N5O2S/c27-19-17(20(28)26(21(29)24-19)16-8-2-1-3-9-16)14-23-25-12-5-4-10-18(25)15-7-6-11-22-13-15/h1-3,6-9,11,13-14,18,23H,4-5,10,12H2,(H,24,27,29)/b17-14+
InChIKey UCKILGJSJQZBJF-SAPNQHFASA-N
Mol Weight 407.49 g/mol
Molecular Formula C21H21N5O2S
Exact Mass 407.141596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzuqtKK6bwJ
Name (5E)-1-phenyl-5-[[(2-pyridin-3-ylpiperidin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21N5O2S
InChI InChI=1S/C21H21N5O2S/c27-19-17(20(28)26(21(29)24-19)16-8-2-1-3-9-16)14-23-25-12-5-4-10-18(25)15-7-6-11-22-13-15/h1-3,6-9,11,13-14,18,23H,4-5,10,12H2,(H,24,27,29)/b17-14+
InChIKey UCKILGJSJQZBJF-SAPNQHFASA-N
Molecular Weight 407.492 g/mol
SMILES N1C(\C(=C/NN2C(c3cnccc3)CCCC2)C(N(C1=S)c1ccccc1)=O)=O
SPLASH splash10-08fr-6900100000-9bc4c5f06177d62bdec2
Synonyms (5E)-1-phenyl-5-[[[2-(3-pyridinyl)-1-piperidinyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (5E)-1-phenyl-5-[[[2-(3-pyridyl)-1-piperidyl]amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione (5E)-1-phenyl-5-[[[2-(3-pyridyl)piperidino]amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone
Wiley ID 1455194