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4H-1,2,4-Triazole-3-carboxamide, 4-(4-chlorophenyl)-N-(4-methoxyphenyl)-N-(2-oxo-1,2-diphenylethyl)-5-phenyl-
SpectraBase Compound ID EUA3NiVf0vQ
InChI InChI=1S/C36H27ClN4O3/c1-44-31-23-21-29(22-24-31)40(32(25-11-5-2-6-12-25)33(42)26-13-7-3-8-14-26)36(43)35-39-38-34(27-15-9-4-10-16-27)41(35)30-19-17-28(37)18-20-30/h2-24,32H,1H3
InChIKey YHOWYEDEPIMBET-UHFFFAOYSA-N
Mol Weight 599.1 g/mol
Molecular Formula C36H27ClN4O3
Exact Mass 598.177168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ryrVYdIbx8
Name 4H-1,2,4-Triazole-3-carboxamide, 4-(4-chlorophenyl)-N-(4-methoxyphenyl)-N-(2-oxo-1,2-diphenylethyl)-5-phenyl-
CAS Registry Number 113372-25-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H27ClN4O3
InChI InChI=1S/C36H27ClN4O3/c1-44-31-23-21-29(22-24-31)40(32(25-11-5-2-6-12-25)33(42)26-13-7-3-8-14-26)36(43)35-39-38-34(27-15-9-4-10-16-27)41(35)30-19-17-28(37)18-20-30/h2-24,32H,1H3
InChIKey YHOWYEDEPIMBET-UHFFFAOYSA-N
Molecular Weight 599.090 g/mol
SMILES COc1ccc(cc1)N(C(c1ccccc1)C(c1ccccc1)=O)C(c1nnc(-c2ccccc2)[n]1-c1ccc(cc1)Cl)=O
SPLASH splash10-0006-0753900000-f8802b242acb93453255
Source of Spectrum Y-24-1283-3
Synonyms 4-(4-Chlorophenyl)-N-(4-methoxyphenyl)-N-(2-oxo-1,2-diphenylethyl)-5-phenyl-4H-1,2,4-triazole-3-carboxamide 4-(4-Chlorophenyl)-N-(4-methoxyphenyl)-N-(2-oxidanylidene-1,2-diphenyl-ethyl)-5-phenyl-1,2,4-triazole-3-carboxamide 4-(4-Chlorophenyl)-N-(4-methoxyphenyl)-N-(2-oxo-1,2-diphenyl-ethyl)-5-phenyl-1,2,4-triazole-3-carboxamide 4-(4-Chlorophenyl)-N-desyl-N-(4-methoxyphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide
Wiley ID 1409985