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5-Methyl-N-phenyl-7-[4-(trifluoromethyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
SpectraBase Compound ID 4EQFHNUztpv
InChI InChI=1S/C20H16F3N5O/c1-12-16(18(29)27-15-5-3-2-4-6-15)17(28-19(26-12)24-11-25-28)13-7-9-14(10-8-13)20(21,22)23/h2-11,17H,1H3,(H,27,29)(H,24,25,26)
InChIKey HQCMZPSKQKKDKT-UHFFFAOYSA-N
Mol Weight 399.38 g/mol
Molecular Formula C20H16F3N5O
Exact Mass 399.130695 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOxSIkEBtQa
Name 5-Methyl-N-phenyl-7-[4-(trifluoromethyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16F3N5O
InChI InChI=1S/C20H16F3N5O/c1-12-16(18(29)27-15-5-3-2-4-6-15)17(28-19(26-12)24-11-25-28)13-7-9-14(10-8-13)20(21,22)23/h2-11,17H,1H3,(H,27,29)(H,24,25,26)
InChIKey HQCMZPSKQKKDKT-UHFFFAOYSA-N
Molecular Weight 399.377 g/mol
SMILES N1C(=C(C(Nc2ccccc2)=O)C([n]2ncnc12)c1ccc(C(F)(F)F)cc1)C
SPLASH splash10-052f-9103000000-e330420b52da44c95527
Synonyms 5-Methyl-N-phenyl-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide [1,2,4]Triazolo[1,5-a]pyrimidine-6-carboxamide, 4,7-dihydro-5-methyl-N-phenyl-7-[4-(trifluoromethyl)phenyl]-
Wiley ID 1450205