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N-acetyl-N'-[2-(4-benzoyl-1-piperazinyl)phenyl]thiourea

View entire compound with spectra: 2 NMR

N-acetyl-N'-[2-(4-benzoyl-1-piperazinyl)phenyl]thiourea
SpectraBase Compound ID 2V4h59nPPxJ
InChI InChI=1S/C20H22N4O2S/c1-15(25)21-20(27)22-17-9-5-6-10-18(17)23-11-13-24(14-12-23)19(26)16-7-3-2-4-8-16/h2-10H,11-14H2,1H3,(H2,21,22,25,27)
InChIKey UHPJXFILCVAJDY-UHFFFAOYSA-N
Mol Weight 382.48 g/mol
Molecular Formula C20H22N4O2S
Exact Mass 382.146347 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JjmSakKHh5
Name N-Acetyl-N'-[2-(4-benzoyl-1-piperazinyl)phenyl]thiourea
Comments Computed using HOSE algorithm
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Exact Mass 382.146347136 u
Formula C20H22N4O2S
InChI InChI=1S/C20H22N4O2S/c1-15(25)21-20(27)22-17-9-5-6-10-18(17)23-11-13-24(14-12-23)19(26)16-7-3-2-4-8-16/h2-10H,11-14H2,1H3,(H2,21,22,25,27)
InChIKey UHPJXFILCVAJDY-UHFFFAOYSA-N
SMILES N(C(NC1=C(N2CCN(C(=O)C3=CC=CC=C3)CC2)C=CC=C1)=S)C(=O)C