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2-(4-Methoxyanilino)-4-(4-nitrophenyl)-5-(3-methylphenylcarbamoyl)-1,3-thiazole

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2-(4-Methoxyanilino)-4-(4-nitrophenyl)-5-(3-methylphenylcarbamoyl)-1,3-thiazole
SpectraBase Compound ID BZp4y9KzdaW
InChI InChI=1S/C25H22N4O4S/c1-3-33-21-13-9-18(10-14-21)27-25-28-22(17-7-11-20(12-8-17)29(31)32)23(34-25)24(30)26-19-6-4-5-16(2)15-19/h4-15H,3H2,1-2H3,(H,26,30)(H,27,28)
InChIKey NNDICKNUUIWFFB-UHFFFAOYSA-N
Mol Weight 474.54 g/mol
Molecular Formula C25H22N4O4S
Exact Mass 474.136176 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GE5w6okUzRK
Name 2-(4-Methoxyanilino)-4-(4-nitrophenyl)-5-(3-methylphenylcarbamoyl)-1,3-thiazole
Comments Computed using HOSE algorithm
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Exact Mass 474.136176374 u
Formula C25H22N4O4S
InChI InChI=1S/C25H22N4O4S/c1-3-33-21-13-9-18(10-14-21)27-25-28-22(17-7-11-20(12-8-17)29(31)32)23(34-25)24(30)26-19-6-4-5-16(2)15-19/h4-15H,3H2,1-2H3,(H,26,30)(H,27,28)
InChIKey NNDICKNUUIWFFB-UHFFFAOYSA-N
Molecular Weight 474.535 g/mol
SMILES N(C1=NC(=C(C(Nc2cc(C)ccc2)=O)S1)c1ccc(N(=O)=O)cc1)c1ccc(cc1)OCC