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2-{[5-cyclopentyl-1-(4-fluorophenyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
SpectraBase Compound ID 70NrJQMUFRU
InChI InChI=1S/C22H24F2N4OS/c23-16-5-9-18(10-6-16)26-21(29)13-30-22-25-14-27(19-3-1-2-4-19)15-28(22)20-11-7-17(24)8-12-20/h5-12,19H,1-4,13-15H2,(H,26,29)
InChIKey RHMZURUUUPROBB-UHFFFAOYSA-N
Mol Weight 430.52 g/mol
Molecular Formula C22H24F2N4OS
Exact Mass 430.163889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXMr2KX4k8q
Name 2-{[5-cyclopentyl-1-(4-fluorophenyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24F2N4OS
InChI InChI=1S/C22H24F2N4OS/c23-16-5-9-18(10-6-16)26-21(29)13-30-22-25-14-27(19-3-1-2-4-19)15-28(22)20-11-7-17(24)8-12-20/h5-12,19H,1-4,13-15H2,(H,26,29)
InChIKey RHMZURUUUPROBB-UHFFFAOYSA-N
Molecular Weight 430.518 g/mol
SMILES N(C(=O)CSC=1N(CN(CN1)C1CCCC1)c1ccc(cc1)F)c1ccc(cc1)F
SPLASH splash10-006w-9820000000-3799f45838595afb6981
Source of Spectrum IY-2-5076-5
Synonyms 2-[[3-cyclopentyl-1-(4-fluorophenyl)-2,4-dihydro-1,3,5-triazin-6-yl]thio]-N-(4-fluorophenyl)acetamide 2-[[3-cyclopentyl-1-(4-fluorophenyl)-2,4-dihydro-1,3,5-triazin-6-yl]sulfanyl]-N-(4-fluorophenyl)acetamide 2-[[3-cyclopentyl-1-(4-fluorophenyl)-2,4-dihydro-1,3,5-triazin-6-yl]sulfanyl]-N-(4-fluorophenyl)ethanamide
Wiley ID 1658748