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(4-{2-[(2-Chloro-phenyl)-(methyl)-amino]-4-methyl-thiazol-5-yl}-pyrimidin-2-yl)-(3-chloro-phenyl)-amine
SpectraBase Compound ID IzhZz6Fq9FN
InChI InChI=1S/C21H17Cl2N5S/c1-13-19(29-21(25-13)28(2)18-9-4-3-8-16(18)23)17-10-11-24-20(27-17)26-15-7-5-6-14(22)12-15/h3-12H,1-2H3,(H,24,26,27)
InChIKey RZFCJHWMXRPWGD-UHFFFAOYSA-N
Mol Weight 442.37 g/mol
Molecular Formula C21H17Cl2N5S
Exact Mass 441.058172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Rradd9c3A5
Name (4-{2-[(2-Chloro-phenyl)-(methyl)-amino]-4-methyl-thiazol-5-yl}-pyrimidin-2-yl)-(3-chloro-phenyl)-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17Cl2N5S
InChI InChI=1S/C21H17Cl2N5S/c1-13-19(29-21(25-13)28(2)18-9-4-3-8-16(18)23)17-10-11-24-20(27-17)26-15-7-5-6-14(22)12-15/h3-12H,1-2H3,(H,24,26,27)
InChIKey RZFCJHWMXRPWGD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201000238
Molecular Weight 442.368 g/mol
SMILES N(c1nccc(n1)-c1c(nc(s1)N(C)c1ccccc1Cl)C)c1cccc(c1)Cl
SPLASH splash10-0a4l-3210900000-75898371756c4cdd6e93
Source of Spectrum APC-344-681-32
Synonyms N-(2-chlorophenyl)-5-(2-((3-chlorophenyl)amino)pyrimidin-4-yl)-N,4-dimethylthiazol-2-amine 5-[2-(3-chloroanilino)-4-pyrimidinyl]-N-(2-chlorophenyl)-N,4-dimethyl-2-thiazolamine 5-[2-(3-chloroanilino)pyrimidin-4-yl]-N-(2-chlorophenyl)-N,4-dimethyl-1,3-thiazol-2-amine 5-[2-(3-chloroanilino)pyrimidin-4-yl]-N-(2-chlorophenyl)-N,4-dimethyl-thiazol-2-amine N-(2-chlorophenyl)-5-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]-N,4-dimethyl-1,3-thiazol-2-amine
Wiley ID 1769124