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3-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-1H-quinazoline-2,4-dione
SpectraBase Compound ID 8hMQGKJj3CV
InChI InChI=1S/C17H10ClN3O2S/c18-12-7-3-1-5-10(12)14-9-24-17(20-14)21-15(22)11-6-2-4-8-13(11)19-16(21)23/h1-9H,(H,19,23)
InChIKey XOUVQBQYRLTUIV-UHFFFAOYSA-N
Mol Weight 355.8 g/mol
Molecular Formula C17H10ClN3O2S
Exact Mass 355.018225 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FBdinPw9Uzi
Name 3-[4-(2-Chlorophenyl)-1,3-thiazol-2-yl]-1H-quinazoline-2,4-dione
Comments Computed using HOSE algorithm
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Exact Mass 355.018225446 u
Formula C17H10ClN3O2S
InChI InChI=1S/C17H10ClN3O2S/c18-12-7-3-1-5-10(12)14-9-24-17(20-14)21-15(22)11-6-2-4-8-13(11)19-16(21)23/h1-9H,(H,19,23)
InChIKey XOUVQBQYRLTUIV-UHFFFAOYSA-N
Molecular Weight 355.799 g/mol
SMILES C1(N2C(NC=3C(C2=O)=CC=CC3)=O)=NC(C2=C(Cl)C=CC=C2)=CS1