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N-[(E)-[4-(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)oxy-3-methoxy-phenyl]methylideneamino]-3-(dimethylamino)benzamide
SpectraBase Compound ID KAtj1wyMs9I
InChI InChI=1S/C21H19ClFN5O3/c1-28(2)15-6-4-5-14(10-15)19(29)27-25-11-13-7-8-17(18(9-13)30-3)31-20-16(23)12-24-21(22)26-20/h4-12H,1-3H3,(H,27,29)/b25-11+
InChIKey DLIPCFCELZWEFS-OPEKNORGSA-N
Mol Weight 443.87 g/mol
Molecular Formula C21H19ClFN5O3
Exact Mass 443.116045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5xEqkn56pU7
Name N-[(E)-[4-(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)oxy-3-methoxy-phenyl]methylideneamino]-3-(dimethylamino)benzamide
Alternate Name(s) N-[(E)-[4-(2-chloro-5-fluoro-pyrimidin-4-yl)oxy-3-methoxy-benzylidene]amino]-3-(dimethylamino)benzamide N-[(E)-[4-(2-chloro-5-fluoro-pyrimidin-4-yl)oxy-3-methoxy-phenyl]methyleneamino]-3-(dimethylamino)benzamide N-[(E)-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxy-3-methoxyphenyl]methylideneamino]-3-(dimethylamino)benzamide N-[(E)-[4-[(2-chloro-5-fluoro-4-pyrimidinyl)oxy]-3-methoxyphenyl]methylideneamino]-3-(dimethylamino)benzamide
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Formula C21H19ClFN5O3
InChI InChI=1S/C21H19ClFN5O3/c1-28(2)15-6-4-5-14(10-15)19(29)27-25-11-13-7-8-17(18(9-13)30-3)31-20-16(23)12-24-21(22)26-20/h4-12H,1-3H3,(H,27,29)/b25-11+
InChIKey DLIPCFCELZWEFS-OPEKNORGSA-N
Molecular Weight 443.866 g/mol
SMILES N(C(c1cc(N(C)C)ccc1)=O)\N=C\c1ccc(Oc2nc(ncc2F)Cl)c(c1)OC
SPLASH splash10-0002-1900000000-75b4d90f26bce316f4a7
Wiley ID 1462401