For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(4-{2-[(4-Chloro-phenyl)-(methyl)-amino]-4-methyl-thiazol-5-yl}-pyrimidin-2-yl)-(4-fluoro-phenyl)-amine
SpectraBase Compound ID J3yXfDkJJOg
InChI InChI=1S/C21H17ClFN5S/c1-13-19(29-21(25-13)28(2)17-9-3-14(22)4-10-17)18-11-12-24-20(27-18)26-16-7-5-15(23)6-8-16/h3-12H,1-2H3,(H,24,26,27)
InChIKey NFPMIVOSMQDZJD-UHFFFAOYSA-N
Mol Weight 425.91 g/mol
Molecular Formula C21H17ClFN5S
Exact Mass 425.087723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7jTGi8SInUJ
Name (4-{2-[(4-Chloro-phenyl)-(methyl)-amino]-4-methyl-thiazol-5-yl}-pyrimidin-2-yl)-(4-fluoro-phenyl)-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17ClFN5S
InChI InChI=1S/C21H17ClFN5S/c1-13-19(29-21(25-13)28(2)17-9-3-14(22)4-10-17)18-11-12-24-20(27-18)26-16-7-5-15(23)6-8-16/h3-12H,1-2H3,(H,24,26,27)
InChIKey NFPMIVOSMQDZJD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201000238
Molecular Weight 425.913 g/mol
SMILES N(c1nccc(n1)-c1c(nc(s1)N(C)c1ccc(cc1)Cl)C)c1ccc(cc1)F
SPLASH splash10-004i-1030900000-2738eb2b81894851101d
Source of Spectrum APC-344-681-29
Synonyms N-(4-chlorophenyl)-5-(2-((4-fluorophenyl)amino)pyrimidin-4-yl)-N,4-dimethylthiazol-2-amine N-(4-chlorophenyl)-5-[2-(4-fluoroanilino)-4-pyrimidinyl]-N,4-dimethyl-2-thiazolamine N-(4-chlorophenyl)-5-[2-(4-fluoroanilino)pyrimidin-4-yl]-N,4-dimethyl-1,3-thiazol-2-amine N-(4-chlorophenyl)-5-[2-(4-fluoroanilino)pyrimidin-4-yl]-N,4-dimethyl-thiazol-2-amine N-(4-chlorophenyl)-5-[2-[(4-fluorophenyl)amino]pyrimidin-4-yl]-N,4-dimethyl-1,3-thiazol-2-amine
Wiley ID 1769121