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(Z)-N-[4-(4-Bromophenyl)-3-phenylthiazol-2(3H)-ylidene]-3-methyl-1H-pyrazol-5-amine
SpectraBase Compound ID DOCjdviuDny
InChI InChI=1S/C19H15BrN4S/c1-13-11-18(23-22-13)21-19-24(16-5-3-2-4-6-16)17(12-25-19)14-7-9-15(20)10-8-14/h2-12H,1H3,(H,22,23)/b21-19-
InChIKey ZCIKDERIMFUZOX-VZCXRCSSSA-N
Mol Weight 411.32 g/mol
Molecular Formula C19H15BrN4S
Exact Mass 410.020081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CdmA73CxHqc
Name (Z)-N-[4-(4-Bromophenyl)-3-phenylthiazol-2(3H)-ylidene]-3-methyl-1H-pyrazol-5-amine
Comments Computed using HOSE algorithm
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Exact Mass 410.020080673 u
Formula C19H15BrN4S
InChI InChI=1S/C19H15BrN4S/c1-13-11-18(23-22-13)21-19-24(16-5-3-2-4-6-16)17(12-25-19)14-7-9-15(20)10-8-14/h2-12H,1H3,(H,22,23)/b21-19-
InChIKey ZCIKDERIMFUZOX-VZCXRCSSSA-N
Molecular Weight 411.321 g/mol
SMILES C=1(N(\C(SC1)=N\C1=CC(C)=NN1)C1=CC=CC=C1)C1=CC=C(C=C1)Br