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1-[3-[2-(2-chlorobenzyl)oxy-3-methoxy-phenyl]-4-(4-morpholinophenyl)-2-phenyl-3H-1,2,4-triazol-5-yl]ethanone
SpectraBase Compound ID 3MJueV4gvuW
InChI InChI=1S/C34H33ClN4O4/c1-24(40)33-36-39(28-10-4-3-5-11-28)34(38(33)27-17-15-26(16-18-27)37-19-21-42-22-20-37)29-12-8-14-31(41-2)32(29)43-23-25-9-6-7-13-30(25)35/h3-18,34H,19-23H2,1-2H3
InChIKey FPOHNVCWPCGDNX-UHFFFAOYSA-N
Mol Weight 597.1 g/mol
Molecular Formula C34H33ClN4O4
Exact Mass 596.219033 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KJdokqwaKqg
Name 1-[3-[2-(2-chlorobenzyl)oxy-3-methoxy-phenyl]-4-(4-morpholinophenyl)-2-phenyl-3H-1,2,4-triazol-5-yl]ethanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H33ClN4O4
InChI InChI=1S/C34H33ClN4O4/c1-24(40)33-36-39(28-10-4-3-5-11-28)34(38(33)27-17-15-26(16-18-27)37-19-21-42-22-20-37)29-12-8-14-31(41-2)32(29)43-23-25-9-6-7-13-30(25)35/h3-18,34H,19-23H2,1-2H3
InChIKey FPOHNVCWPCGDNX-UHFFFAOYSA-N
Molecular Weight 597.115 g/mol
SMILES c1ccc(N2C(N(C(=N2)C(=O)C)c2ccc(N3CCOCC3)cc2)c2c(OCc3c(Cl)cccc3)c(OC)ccc2)cc1
SPLASH splash10-0002-0119110000-f180f6bd3601c5498762
Synonyms 1-[3-[2-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]-4-(4-morpholin-4-ylphenyl)-2-phenyl-3H-1,2,4-triazol-5-yl]ethanone 1-[3-[2-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]-4-(4-morpholinophenyl)-2-phenyl-3H-1,2,4-triazol-5-yl]ethanone 1-[3-[2-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]-4-[4-(4-morpholinyl)phenyl]-2-phenyl-3H-1,2,4-triazol-5-yl]ethanone
Wiley ID 1454706