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N-Allyl-N-[6-(4-methoxyphenyl)-4-(trifluoromethyl)pyrimidin-2-yl]-1H-benzo[d]imidazol-2-amine
SpectraBase Compound ID 1IfeqcQtMm5
InChI InChI=1S/C22H18F3N5O/c1-3-12-30(20-26-16-6-4-5-7-17(16)27-20)21-28-18(13-19(29-21)22(23,24)25)14-8-10-15(31-2)11-9-14/h3-11,13H,1,12H2,2H3,(H,26,27)
InChIKey DIEKIAORFUZTOU-UHFFFAOYSA-N
Mol Weight 425.42 g/mol
Molecular Formula C22H18F3N5O
Exact Mass 425.146345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlVqxskUsFx
Name N-Allyl-N-[6-(4-methoxyphenyl)-4-(trifluoromethyl)pyrimidin-2-yl]-1H-benzo[d]imidazol-2-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18F3N5O
InChI InChI=1S/C22H18F3N5O/c1-3-12-30(20-26-16-6-4-5-7-17(16)27-20)21-28-18(13-19(29-21)22(23,24)25)14-8-10-15(31-2)11-9-14/h3-11,13H,1,12H2,2H3,(H,26,27)
InChIKey DIEKIAORFUZTOU-UHFFFAOYSA-N
Molecular Weight 425.415 g/mol
SMILES [nH]1c(nc2c1cccc2)N(c1nc(cc(n1)-c1ccc(cc1)OC)C(F)(F)F)CC=C
SPLASH splash10-03dj-0408900000-7c3ace97c03be52d73c6
Source of Spectrum AH-146-1857-5f
Synonyms N-allyl-N-(4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl)-1H-benzo[d]imidazol-2-amine
Wiley ID 1801975