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(Z)-3-Phenyl-4-(4-bromophenyl)-2-[(E)-(1-phenylethylidene)hydrazono]-2,3-dihydrothiazole
SpectraBase Compound ID 4pLx5NEU0ca
InChI InChI=1S/C23H18BrN3S/c1-17(18-8-4-2-5-9-18)25-26-23-27(21-10-6-3-7-11-21)22(16-28-23)19-12-14-20(24)15-13-19/h2-16H,1H3/b25-17+,26-23-
InChIKey IRXZDCLUVZOYNX-SHDDXADGSA-N
Mol Weight 448.38 g/mol
Molecular Formula C23H18BrN3S
Exact Mass 447.040482 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CIpwvNkPDtq
Name (Z)-3-Phenyl-4-(4-bromophenyl)-2-[(E)-(1-phenylethylidene)hydrazono]-2,3-dihydrothiazole
Comments Computed using HOSE algorithm
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Exact Mass 447.040481766 u
Formula C23H18BrN3S
InChI InChI=1S/C23H18BrN3S/c1-17(18-8-4-2-5-9-18)25-26-23-27(21-10-6-3-7-11-21)22(16-28-23)19-12-14-20(24)15-13-19/h2-16H,1H3/b25-17+,26-23-
InChIKey IRXZDCLUVZOYNX-SHDDXADGSA-N
Molecular Weight 448.382 g/mol
SMILES C=1C=C(C=CC1C=1N(C2=CC=CC=C2)\C(=N\N=C/(C)C=2C=CC=CC2)SC1)Br