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3-Chloranyl-N-[[(4-methoxyphenyl)amino]-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)amino]methylidene]benzamide
SpectraBase Compound ID 1Dqgev3VOsx
InChI InChI=1S/C20H18ClN5O3/c1-12-10-17(27)24-19(22-12)26-20(23-15-6-8-16(29-2)9-7-15)25-18(28)13-4-3-5-14(21)11-13/h3-11H,1-2H3,(H3,22,23,24,25,26,27,28)
InChIKey UAGLWWKGWNMJKN-UHFFFAOYSA-N
Mol Weight 411.85 g/mol
Molecular Formula C20H18ClN5O3
Exact Mass 411.109817 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E1x1Z1MdbNK
Name 3-Chloranyl-N-[[(4-methoxyphenyl)amino]-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)amino]methylidene]benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18ClN5O3
InChI InChI=1S/C20H18ClN5O3/c1-12-10-17(27)24-19(22-12)26-20(23-15-6-8-16(29-2)9-7-15)25-18(28)13-4-3-5-14(21)11-13/h3-11H,1-2H3,(H3,22,23,24,25,26,27,28)
InChIKey UAGLWWKGWNMJKN-UHFFFAOYSA-N
Molecular Weight 411.849 g/mol
SMILES N1C(=CC(N=C1N\C(NC(c1cc(Cl)ccc1)=O)=N/c1ccc(cc1)OC)=O)C
SPLASH splash10-0076-7900000000-b8a9ed2c9ff8779d442c
Synonyms 3-Chloro-N-[(4-methoxyanilino)-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]methylene]benzamide 3-Chloro-N-[(4-methoxyanilino)-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]methylidene]benzamide 3-Chloro-N-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)amino]-(p-anisidino)methylene]benzamide
Wiley ID 1445076