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1,6-Diphenyl-2-(benzylthio)-isothio-biurea
SpectraBase Compound ID E4StNcX2adu
InChI InChI=1S/C21H20N4OS/c26-20(22-18-12-6-2-7-13-18)24-25-21(23-19-14-8-3-9-15-19)27-16-17-10-4-1-5-11-17/h1-15H,16H2,(H,23,25)(H2,22,24,26)
InChIKey WHLNJJKEBWGQDG-UHFFFAOYSA-N
Mol Weight 376.48 g/mol
Molecular Formula C21H20N4OS
Exact Mass 376.135782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xbXA7TsR2T
Name 1,6-Diphenyl-2-(benzylthio)-isothio-biurea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N4OS
InChI InChI=1S/C21H20N4OS/c26-20(22-18-12-6-2-7-13-18)24-25-21(23-19-14-8-3-9-15-19)27-16-17-10-4-1-5-11-17/h1-15H,16H2,(H,23,25)(H2,22,24,26)
InChIKey WHLNJJKEBWGQDG-UHFFFAOYSA-N
Molecular Weight 376.478 g/mol
SMILES N(C(Nc1ccccc1)=O)\N=C\(Nc1ccccc1)SCc1ccccc1
SPLASH splash10-0006-9000000000-471d39c2099e3e2cebdd
Source of Spectrum SK-31-1604-2
Synonyms N-[[anilino(oxo)methyl]amino]-N'-phenylcarbamimidothioic acid (phenylmethyl) ester benzyl N'-phenyl-N-(phenylcarbamoylamino)carbamimidothioate 1-[(C-benzylsulfanyl-N-phenyl-carbonimidoyl)amino]-3-phenyl-urea (phenylmethyl) N'-phenyl-N-(phenylcarbamoylamino)carbamimidothioate
Wiley ID 881984