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N-(tert-Butyl)-2-(4-chlorophenyl)-3-ethyl-4-(4-methoxybenzoyl)-4,5-dihydro-3H-1,4-benzodiazepine-5-carboxamide
SpectraBase Compound ID Bt9b478WuYp
InChI InChI=1S/C30H32ClN3O3/c1-6-25-26(19-11-15-21(31)16-12-19)32-24-10-8-7-9-23(24)27(28(35)33-30(2,3)4)34(25)29(36)20-13-17-22(37-5)18-14-20/h7-18,25,27H,6H2,1-5H3,(H,33,35)
InChIKey KJMKDZMZXLEJSQ-UHFFFAOYSA-N
Mol Weight 518.1 g/mol
Molecular Formula C30H32ClN3O3
Exact Mass 517.21322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8fI7zj1lkN
Name N-(tert-Butyl)-2-(4-chlorophenyl)-3-ethyl-4-(4-methoxybenzoyl)-4,5-dihydro-3H-1,4-benzodiazepine-5-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H32ClN3O3
InChI InChI=1S/C30H32ClN3O3/c1-6-25-26(19-11-15-21(31)16-12-19)32-24-10-8-7-9-23(24)27(28(35)33-30(2,3)4)34(25)29(36)20-13-17-22(37-5)18-14-20/h7-18,25,27H,6H2,1-5H3,(H,33,35)
InChIKey KJMKDZMZXLEJSQ-UHFFFAOYSA-N
Molecular Weight 518.057 g/mol
SMILES N(C(C1N(C(C(=Nc2c1cccc2)c1ccc(cc1)Cl)CC)C(c1ccc(cc1)OC)=O)=O)C(C)(C)C
SPLASH splash10-000i-0900000000-d2fc68b827dab402b484
Source of Spectrum F-69-9060-12o
Synonyms N-(tert-butyl)-2-(4-chlorophenyl)-3-ethyl-4-(4-methoxybenzoyl)-4,5-dihydro-3H-benzo[e][1,4]diazepine-5-carboxamide
Wiley ID 1738589