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4H-1,2,4-Triazole-3-carboxamide, 4-(4-bromophenyl)-N-(4-methylphenyl)-N-(2-oxo-1,2-diphenylethyl)-5-phenyl-
SpectraBase Compound ID 6GWikzyPR5S
InChI InChI=1S/C36H27BrN4O2/c1-25-17-21-30(22-18-25)40(32(26-11-5-2-6-12-26)33(42)27-13-7-3-8-14-27)36(43)35-39-38-34(28-15-9-4-10-16-28)41(35)31-23-19-29(37)20-24-31/h2-24,32H,1H3
InChIKey NPFYEYSWNRSCQG-UHFFFAOYSA-N
Mol Weight 627.5 g/mol
Molecular Formula C36H27BrN4O2
Exact Mass 626.131739 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnCd4tAsOpa
Name 4H-1,2,4-Triazole-3-carboxamide, 4-(4-bromophenyl)-N-(4-methylphenyl)-N-(2-oxo-1,2-diphenylethyl)-5-phenyl-
Alternate Name(s) 4-(4-Bromophenyl)-N-(4-methylphenyl)-N-(2-oxo-1,2-diphenylethyl)-5-phenyl-4H-1,2,4-triazole-3-carboxamide 4-(4-bromophenyl)-N-(2-oxo-1,2-diphenyl-ethyl)-5-phenyl-N-(p-tolyl)-1,2,4-triazole-3-carboxamide 4-(4-bromophenyl)-N-(4-methylphenyl)-N-(2-oxidanylidene-1,2-diphenyl-ethyl)-5-phenyl-1,2,4-triazole-3-carboxamide 4-(4-bromophenyl)-N-(4-methylphenyl)-N-(2-oxo-1,2-diphenylethyl)-5-phenyl-1,2,4-triazole-3-carboxamide 4-(4-bromophenyl)-N-desyl-5-phenyl-N-(p-tolyl)-1,2,4-triazole-3-carboxamide
CAS Registry Number 113372-24-0
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Formula C36H27BrN4O2
InChI InChI=1S/C36H27BrN4O2/c1-25-17-21-30(22-18-25)40(32(26-11-5-2-6-12-26)33(42)27-13-7-3-8-14-27)36(43)35-39-38-34(28-15-9-4-10-16-28)41(35)31-23-19-29(37)20-24-31/h2-24,32H,1H3
InChIKey NPFYEYSWNRSCQG-UHFFFAOYSA-N
Molecular Weight 627.542 g/mol
SMILES Cc1ccc(cc1)N(C(c1ccccc1)C(c1ccccc1)=O)C(c1nnc(-c2ccccc2)[n]1-c1ccc(cc1)Br)=O
SPLASH splash10-00fu-2817190000-bfe61d8c3448bc7ef7dc
Source of Spectrum Y-24-1283-3
Wiley ID 1411884