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N-(4,6-Dimethyl-pyrimidin-2-yl)-N'-(3-fluoro-benzoyl)-N''-(4-methoxy-phenyl)-guanidine
SpectraBase Compound ID Jn6yC6QiP62
InChI InChI=1S/C21H20FN5O2/c1-13-11-14(2)24-20(23-13)27-21(25-17-7-9-18(29-3)10-8-17)26-19(28)15-5-4-6-16(22)12-15/h4-12H,1-3H3,(H2,23,24,25,26,27,28)
InChIKey SQHFTSXSUJVWMM-UHFFFAOYSA-N
Mol Weight 393.42 g/mol
Molecular Formula C21H20FN5O2
Exact Mass 393.160103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H5iYtHkKmjk
Name N-(4,6-Dimethyl-pyrimidin-2-yl)-N'-(3-fluoro-benzoyl)-N''-(4-methoxy-phenyl)-guanidine
Alternate Name(s) N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-(4-methoxyanilino)methylidene]-3-fluorobenzamide N-[[(4,6-dimethylpyrimidin-2-yl)amino]-(4-methoxyanilino)methylene]-3-fluoro-benzamide N-[[(4,6-dimethylpyrimidin-2-yl)amino]-(4-methoxyanilino)methylidene]-3-fluorobenzamide N-[[(4,6-dimethylpyrimidin-2-yl)amino]-(p-anisidino)methylene]-3-fluoro-benzamide N-[[(4,6-dimethylpyrimidin-2-yl)amino]-[(4-methoxyphenyl)amino]methylidene]-3-fluoranyl-benzamide
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Formula C21H20FN5O2
InChI InChI=1S/C21H20FN5O2/c1-13-11-14(2)24-20(23-13)27-21(25-17-7-9-18(29-3)10-8-17)26-19(28)15-5-4-6-16(22)12-15/h4-12H,1-3H3,(H2,23,24,25,26,27,28)
InChIKey SQHFTSXSUJVWMM-UHFFFAOYSA-N
Molecular Weight 393.422 g/mol
SMILES N(\C(=N\C(=O)c1cc(ccc1)F)Nc1ccc(cc1)OC)c1nc(cc(n1)C)C
SPLASH splash10-00di-6900000000-244d76b211dd61f8eb7e
Wiley ID 1466067