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(5E)-5-(3-pyridinylmethylene)-2-sulfanyl-1,3-thiazol-4(5H)-one
SpectraBase Compound ID JzsOIGOWrg
InChI InChI=1S/C9H6N2OS2/c12-8-7(14-9(13)11-8)4-6-2-1-3-10-5-6/h1-5H,(H,11,12,13)/b7-4+
InChIKey WCMBSDRTRVIVGG-QPJJXVBHSA-N
Mol Weight 222.28 g/mol
Molecular Formula C9H6N2OS2
Exact Mass 221.992155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjdSkNwVEjs
Name (5E)-5-(3-Pyridinylmethylene)-2-sulfanyl-1,3-thiazol-4(5H)-one
CAS Registry Number 3785-78-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N2OS2
InChI InChI=1S/C9H6N2OS2/c12-8-7(14-9(13)11-8)4-6-2-1-3-10-5-6/h1-5H,(H,11,12,13)/b7-4+
InChIKey WCMBSDRTRVIVGG-QPJJXVBHSA-N
Molecular Weight 222.280 g/mol
SMILES SC1=NC(\C(=C/c2cnccc2)S1)=O
SPLASH splash10-0079-4930000000-8f598a72c9607eab5cf1
Synonyms (5E)-5-(3-pyridinylmethylidene)-2-sulfanylidene-4-thiazolidinone (5E)-5-(3-pyridylmethylene)-2-thioxo-thiazolidin-4-one (5E)-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one 2-Mercapto-5-pyridin-3-ylmethylene-thiazol-4-one 5-(3-Pyridylmethylene)rhodanine BRN 0150377 NSC 24488
Wiley ID 1460899