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5-Ethoxycarbonyl-2,5-diphenyl[1,2,4]triazolidine-3-thione
SpectraBase Compound ID I6zZr1xCvnd
InChI InChI=1S/C17H17N3O2S/c1-2-22-15(21)17(13-9-5-3-6-10-13)18-16(23)20(19-17)14-11-7-4-8-12-14/h3-12,19H,2H2,1H3,(H,18,23)
InChIKey HPBPDVOLRZXMSP-UHFFFAOYSA-N
Mol Weight 327.4 g/mol
Molecular Formula C17H17N3O2S
Exact Mass 327.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0vPLsES23I
Name 5-Ethoxycarbonyl-2,5-diphenyl[1,2,4]triazolidine-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17N3O2S
InChI InChI=1S/C17H17N3O2S/c1-2-22-15(21)17(13-9-5-3-6-10-13)18-16(23)20(19-17)14-11-7-4-8-12-14/h3-12,19H,2H2,1H3,(H,18,23)
InChIKey HPBPDVOLRZXMSP-UHFFFAOYSA-N
Molecular Weight 327.402 g/mol
SMILES N1C(N(NC1(C(=O)OCC)c1ccccc1)c1ccccc1)=S
SPLASH splash10-0udl-3390000000-c4d82971cd0bac5a80d5
Source of Spectrum H1-50-255-3
Synonyms Ethyl 1,3-diphenyl-5-thioxo-1,2,4-triazolidine-3-carboxylate
Wiley ID 816804