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1-([2,2']Bithiophenyl-5-carbonyl)-3-(4-chloro-phenyl)-urea

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

1-([2,2']Bithiophenyl-5-carbonyl)-3-(4-chloro-phenyl)-urea
SpectraBase Compound ID GLsJAkrwNAM
InChI InChI=1S/C16H11ClN2O2S2/c17-10-3-5-11(6-4-10)18-16(21)19-15(20)14-8-7-13(23-14)12-2-1-9-22-12/h1-9H,(H2,18,19,20,21)
InChIKey QMUKAKQHHWLWIF-UHFFFAOYSA-N
Mol Weight 362.85 g/mol
Molecular Formula C16H11ClN2O2S2
Exact Mass 361.995048 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 82QZvAVjJco
Name 1-([2,2']Bithiophenyl-5-carbonyl)-3-(4-chloro-phenyl)-urea
Comments Computed using HOSE algorithm
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Exact Mass 361.995047648 u
Formula C16H11ClN2O2S2
InChI InChI=1S/C16H11ClN2O2S2/c17-10-3-5-11(6-4-10)18-16(21)19-15(20)14-8-7-13(23-14)12-2-1-9-22-12/h1-9H,(H2,18,19,20,21)
InChIKey QMUKAKQHHWLWIF-UHFFFAOYSA-N
Molecular Weight 362.849 g/mol
SMILES C1=C(C=CC(=C1)NC(NC(C=1SC(C=2SC=CC2)=CC1)=O)=O)Cl