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N-(2-Thiophenecarbonyl)-1,3-diphenyl-5-amino-1H-pyrazole

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

N-(2-Thiophenecarbonyl)-1,3-diphenyl-5-amino-1H-pyrazole
SpectraBase Compound ID CzHH915z2LP
InChI InChI=1S/C20H15N3OS/c24-20(18-12-7-13-25-18)21-19-14-17(15-8-3-1-4-9-15)22-23(19)16-10-5-2-6-11-16/h1-14H,(H,21,24)
InChIKey MZMZMDCWQLMSOD-UHFFFAOYSA-N
Mol Weight 345.42 g/mol
Molecular Formula C20H15N3OS
Exact Mass 345.093583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID zRfMa6Pb8B
Name N-(2-Thiophenecarbonyl)-1,3-diphenyl-5-amino-1H-pyrazole
Comments Computed using HOSE algorithm
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Exact Mass 345.093583288 u
Formula C20H15N3OS
InChI InChI=1S/C20H15N3OS/c24-20(18-12-7-13-25-18)21-19-14-17(15-8-3-1-4-9-15)22-23(19)16-10-5-2-6-11-16/h1-14H,(H,21,24)
InChIKey MZMZMDCWQLMSOD-UHFFFAOYSA-N
Molecular Weight 345.420 g/mol
SMILES C=1(N(N=C(C1)C=1C=CC=CC1)C1=CC=CC=C1)NC(C=1SC=CC1)=O