Ethanone, 1-[4,5-dihydro-4-tert-butyl-1-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)]-1H-1,2,4-triazol-3-yl]-

SpectraBase Compound ID	1XvwqNSq7Kh
InChI	InChI=1S/C22H26ClN3O3/c1-14(27)20-24-26(17-10-8-16(23)9-11-17)21(25(20)22(2,3)4)15-7-12-18(28-5)19(13-15)29-6/h7-13,21H,1-6H3
InChIKey	LXLLULKDSZYJJF-UHFFFAOYSA-N Google Search
Mol Weight	415.92 g/mol
Molecular Formula	C22H26ClN3O3
Exact Mass	415.166269 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	2z9htX0xMbq
Name	Ethanone, 1-[4,5-dihydro-4-tert-butyl-1-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)]-1H-1,2,4-triazol-3-yl]-
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H26ClN3O3
InChI	InChI=1S/C22H26ClN3O3/c1-14(27)20-24-26(17-10-8-16(23)9-11-17)21(25(20)22(2,3)4)15-7-12-18(28-5)19(13-15)29-6/h7-13,21H,1-6H3
InChIKey	LXLLULKDSZYJJF-UHFFFAOYSA-N
Molecular Weight	415.921 g/mol
SMILES	COc1ccc(C2N(c3ccc(cc3)Cl)N=C(N2C(C)(C)C)C(=O)C)cc1OC
SPLASH	splash10-05fr-7984100000-b46b8dc9720637d19e0d
Source of Spectrum	AD-0-2532-0
Synonyms	1-[4-tert-Butyl-1-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone 1-[4-tert-butyl-2-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-3H-1,2,4-triazol-5-yl]ethanone
Wiley ID	1420179