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N-(2-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]ethyl)-N'-phenylthiourea

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(2-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]ethyl)-N'-phenylthiourea
SpectraBase Compound ID 1czBNp81WSg
InChI InChI=1S/C15H18N4S2/c1-11-10-12(2)18-15(17-11)21-9-8-16-14(20)19-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3,(H2,16,19,20)
InChIKey GVJFFWWLFNYAIG-UHFFFAOYSA-N
Mol Weight 318.46 g/mol
Molecular Formula C15H18N4S2
Exact Mass 318.097289 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BotvTTkB0Ud
Name Thiourea, N'-phenyl-N''-[2-(4,6-dimethylpyrimidin-2-ylthio)ethyl]-
Comments Computed using HOSE algorithm
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Exact Mass 318.097288944 u
Formula C15H18N4S2
InChI InChI=1S/C15H18N4S2/c1-11-10-12(2)18-15(17-11)21-9-8-16-14(20)19-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3,(H2,16,19,20)
InChIKey GVJFFWWLFNYAIG-UHFFFAOYSA-N
Molecular Weight 318.457 g/mol
SMILES C1(=NC(C)=CC(=N1)C)SCCNC(NC1=CC=CC=C1)=S