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

*Links on SpectraBase are not permalinks.
4-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine
SpectraBase Compound ID 8Uj3pbmvvjx
InChI InChI=1S/C22H21FN8OS/c23-16-6-4-5-15(13-16)19-28-29-22(31(19)17-7-2-1-3-8-17)33-14-18-25-20(24)27-21(26-18)30-9-11-32-12-10-30/h1-8,13H,9-12,14H2,(H2,24,25,26,27)
InChIKey VZLADPMJVNCXQS-UHFFFAOYSA-N
Mol Weight 464.52 g/mol
Molecular Formula C22H21FN8OS
Exact Mass 464.154307 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 FsKg2FXVR6K
Name 4-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21FN8OS
InChI InChI=1S/C22H21FN8OS/c23-16-6-4-5-15(13-16)19-28-29-22(31(19)17-7-2-1-3-8-17)33-14-18-25-20(24)27-21(26-18)30-9-11-32-12-10-30/h1-8,13H,9-12,14H2,(H2,24,25,26,27)
InChIKey VZLADPMJVNCXQS-UHFFFAOYSA-N
Molecular Weight 464.523 g/mol
SMILES Nc1nc(nc(n1)CSc1[n](c(nn1)-c1cc(F)ccc1)-c1ccccc1)N1CCOCC1
SPLASH splash10-0006-4910000000-030d82a3781aea1bc2db
Synonyms 4-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6-morpholino-1,3,5-triazin-2-amine 4-[[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-6-(4-morpholinyl)-1,3,5-triazin-2-amine [4-[[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-6-morpholino-s-triazin-2-yl]amine
Wiley ID 1460105