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3-(benzyl)-1-phenyl-1-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)thiourea
SpectraBase Compound ID FTzcAAaur1N
InChI InChI=1S/C19H21N3S2/c23-18(21-15-16-9-3-1-4-10-16)22(17-11-5-2-6-12-17)19-20-13-7-8-14-24-19/h1-6,9-12H,7-8,13-15H2,(H,21,23)
InChIKey UTKOEQRQDHASHV-UHFFFAOYSA-N
Mol Weight 355.52 g/mol
Molecular Formula C19H21N3S2
Exact Mass 355.11769 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 86EtGHtnphL
Name 3-(benzyl)-1-phenyl-1-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)thiourea
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21N3S2
InChI InChI=1S/C19H21N3S2/c23-18(21-15-16-9-3-1-4-10-16)22(17-11-5-2-6-12-17)19-20-13-7-8-14-24-19/h1-6,9-12H,7-8,13-15H2,(H,21,23)
InChIKey UTKOEQRQDHASHV-UHFFFAOYSA-N
Literature Reference Author M.G.LEVKOVICH,N.D.ABDULLAEV,R.F.AMBARTSUMOVA
Literature Reference Citation CHEM.HET.COMP.,38,612(2002)
Literature Reference DOI 10.1023/a:1019577600569
Molecular Weight 355.516 g/mol
Solvent CDCl3
Source File Reference UWMZ10835