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2-[(Benzylidene)hydrazino]-4-antipyrinylthiazole

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

2-[(Benzylidene)hydrazino]-4-antipyrinylthiazole
SpectraBase Compound ID 1m52o4m55IM
InChI InChI=1S/C21H19N5OS/c1-15-19(20(27)26(25(15)2)17-11-7-4-8-12-17)18-14-28-21(23-18)24-22-13-16-9-5-3-6-10-16/h3-14H,1-2H3,(H,23,24)/b22-13+
InChIKey BUFXTGHNQIJMFC-LPYMAVHISA-N
Mol Weight 389.48 g/mol
Molecular Formula C21H19N5OS
Exact Mass 389.131031 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3kAdm4DPqN9
Name 2-[(Benzylidene)hydrazino]-4-antipyrinylthiazole
Comments Computed using HOSE algorithm
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Exact Mass 389.131031425 u
Formula C21H19N5OS
InChI InChI=1S/C21H19N5OS/c1-15-19(20(27)26(25(15)2)17-11-7-4-8-12-17)18-14-28-21(23-18)24-22-13-16-9-5-3-6-10-16/h3-14H,1-2H3,(H,23,24)/b22-13+
InChIKey BUFXTGHNQIJMFC-LPYMAVHISA-N
Molecular Weight 389.477 g/mol
SMILES C=1(C(N(C=2C=CC=CC2)N(C1C)C)=O)C=1N=C(N\N=C\C=2C=CC=CC2)SC1