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N1-[2-(4,6-dimethylpyridin-2-yl)-1-phenylethenyl]-N2-[(3-chlorophenyl)aminocarbonyl]benzamidine
SpectraBase Compound ID 1pSrF0yySfs
InChI InChI=1S/C29H25ClN4O/c1-20-16-21(2)31-26(17-20)19-27(22-10-5-3-6-11-22)33-28(23-12-7-4-8-13-23)34-29(35)32-25-15-9-14-24(30)18-25/h3-19H,1-2H3,(H2,32,33,34,35)/b27-19+
InChIKey NKFKCQJXIHBPFC-ZXVVBBHZSA-N
Mol Weight 481.0 g/mol
Molecular Formula C29H25ClN4O
Exact Mass 480.171689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EsMmXEtXXWu
Name N1-[2-(4,6-dimethylpyridin-2-yl)-1-phenylethenyl]-N2-[(3-chlorophenyl)aminocarbonyl]benzamidine
Alternate Name(s) N-(3-chlorophenyl)-N'-[(E)-{[(E)-2-(4,6-dimethyl-2-pyridinyl)-1-phenylethenyl]amino}(phenyl)methylidene]urea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H25ClN4O
InChI InChI=1S/C29H25ClN4O/c1-20-16-21(2)31-26(17-20)19-27(22-10-5-3-6-11-22)33-28(23-12-7-4-8-13-23)34-29(35)32-25-15-9-14-24(30)18-25/h3-19H,1-2H3,(H2,32,33,34,35)/b27-19+
InChIKey NKFKCQJXIHBPFC-ZXVVBBHZSA-N
Molecular Weight 480.999 g/mol
SMILES N(\C(=C\c1nc(C)cc(c1)C)c1ccccc1)\C(=N\C(Nc1cc(Cl)ccc1)=O)c1ccccc1
SPLASH splash10-0fk9-0492100000-8af14b18f5383d27844b
Source of Spectrum SO-0-413-2
Wiley ID 1540030