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(4-{2-[(3-Chloro-4-fluoro-phenyl)-(methyl)-amino]-4-methylthiazol-5-yl}-pyrimidin-2-yl)-o-tolyl-amine
SpectraBase Compound ID 7YwpYBHcYlP
InChI InChI=1S/C22H19ClFN5S/c1-13-6-4-5-7-18(13)27-21-25-11-10-19(28-21)20-14(2)26-22(30-20)29(3)15-8-9-17(24)16(23)12-15/h4-12H,1-3H3,(H,25,27,28)
InChIKey JNUUVFAEULIYEG-UHFFFAOYSA-N
Mol Weight 439.94 g/mol
Molecular Formula C22H19ClFN5S
Exact Mass 439.103373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJaVyjXRH19
Name (4-{2-[(3-Chloro-4-fluoro-phenyl)-(methyl)-amino]-4-methylthiazol-5-yl}-pyrimidin-2-yl)-o-tolyl-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19ClFN5S
InChI InChI=1S/C22H19ClFN5S/c1-13-6-4-5-7-18(13)27-21-25-11-10-19(28-21)20-14(2)26-22(30-20)29(3)15-8-9-17(24)16(23)12-15/h4-12H,1-3H3,(H,25,27,28)
InChIKey JNUUVFAEULIYEG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201000238
Molecular Weight 439.940 g/mol
SMILES N(c1nccc(n1)-c1c(nc(s1)N(C)c1cc(Cl)c(cc1)F)C)c1ccccc1C
SPLASH splash10-007c-5320900000-f896486d15c6f24cf7fc
Source of Spectrum APC-344-682-41
Synonyms N-(3-chloro-4-fluorophenyl)-N,4-dimethyl-5-(2-(o-tolylamino)pyrimidin-4-yl)thiazol-2-amine N-(3-chloro-4-fluorophenyl)-N,4-dimethyl-5-[2-(2-methylanilino)-4-pyrimidinyl]-2-thiazolamine N-(3-chloro-4-fluorophenyl)-N,4-dimethyl-5-[2-(2-methylanilino)pyrimidin-4-yl]-1,3-thiazol-2-amine N-(3-chloro-4-fluoro-phenyl)-N,4-dimethyl-5-[2-(2-methylanilino)pyrimidin-4-yl]thiazol-2-amine N-(3-chloranyl-4-fluoranyl-phenyl)-N,4-dimethyl-5-[2-[(2-methylphenyl)amino]pyrimidin-4-yl]-1,3-thiazol-2-amine
Wiley ID 1769131