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thiourea, N-[5-(2-benzoxazolyl)-2-methylphenyl]-N'-(2-thienylcarbonyl)-

View entire compound with spectra: 2 NMR

thiourea, N-[5-(2-benzoxazolyl)-2-methylphenyl]-N'-(2-thienylcarbonyl)-
SpectraBase Compound ID LTjLe428IRm
InChI InChI=1S/C20H15N3O2S2/c1-12-8-9-13(19-21-14-5-2-3-6-16(14)25-19)11-15(12)22-20(26)23-18(24)17-7-4-10-27-17/h2-11H,1H3,(H2,22,23,24,26)
InChIKey DDLRNGPHWKYLDY-UHFFFAOYSA-N
Mol Weight 393.48 g/mol
Molecular Formula C20H15N3O2S2
Exact Mass 393.060569 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DhCtyRMLVJs
Name Thiourea, N-[5-(2-benzoxazolyl)-2-methylphenyl]-N'-(2-thienylcarbonyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 393.060569081 u
Formula C20H15N3O2S2
InChI InChI=1S/C20H15N3O2S2/c1-12-8-9-13(19-21-14-5-2-3-6-16(14)25-19)11-15(12)22-20(26)23-18(24)17-7-4-10-27-17/h2-11H,1H3,(H2,22,23,24,26)
InChIKey DDLRNGPHWKYLDY-UHFFFAOYSA-N
Molecular Weight 393.479 g/mol
SMILES N(C(NC(C=1SC=CC1)=O)=S)C=1C=C(C2=NC=3C=CC=CC3O2)C=CC1C