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1H-benzimidazol-2-yl N'-(4-fluorobenzoyl)carbamimidothioate
SpectraBase Compound ID 7BjDyyMGtw5
InChI InChI=1S/C15H11FN4OS/c16-10-7-5-9(6-8-10)13(21)20-14(17)22-15-18-11-3-1-2-4-12(11)19-15/h1-8H,(H,18,19)(H2,17,20,21)
InChIKey KCXKSJYDGGGWTO-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C15H11FN4OS
Exact Mass 314.06376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWnVf6EpERg
Name 1H-benzimidazol-2-yl N'-(4-fluorobenzoyl)carbamimidothioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11FN4OS
InChI InChI=1S/C15H11FN4OS/c16-10-7-5-9(6-8-10)13(21)20-14(17)22-15-18-11-3-1-2-4-12(11)19-15/h1-8H,(H,18,19)(H2,17,20,21)
InChIKey KCXKSJYDGGGWTO-UHFFFAOYSA-N
Molecular Weight 314.338 g/mol
SMILES [nH]1c2ccccc2nc1S\C(=N\C(c1ccc(cc1)F)=O)N
SPLASH splash10-00dm-9800000000-2d669546e7c438ef9295
Synonyms 1H-benzimidazol-2-yl N'-(4-fluorophenyl)carbonylcarbamimidothioate Isothiourea, 2-(1H-benzoimidazol-2-yl)-1-(4-fluorobenzoyl)- N'-[(4-fluorophenyl)-oxomethyl]carbamimidothioic acid 1H-benzimidazol-2-yl ester N-[amino(1H-benzimidazol-2-ylsulfanyl)methylene]-4-fluoro-benzamide N-[amino-(1H-benzimidazol-2-ylthio)methylene]-4-fluoro-benzamide
Wiley ID 1444049