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3H-Imidazole-4-carboxylic acid, 3-methyl-5-[(pyridin-4-ylmethylene)amino]-, (4-tert-butylphenyl)amide
SpectraBase Compound ID CnWxkETZcty
InChI InChI=1S/C21H23N5O/c1-21(2,3)16-5-7-17(8-6-16)25-20(27)18-19(24-14-26(18)4)23-13-15-9-11-22-12-10-15/h5-14H,1-4H3,(H,25,27)/b23-13+
InChIKey KXPJUQKSGATSDY-YDZHTSKRSA-N
Mol Weight 361.45 g/mol
Molecular Formula C21H23N5O
Exact Mass 361.19026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uquQz4a96c
Name 3H-Imidazole-4-carboxylic acid, 3-methyl-5-[(pyridin-4-ylmethylene)amino]-, (4-tert-butylphenyl)amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N5O
InChI InChI=1S/C21H23N5O/c1-21(2,3)16-5-7-17(8-6-16)25-20(27)18-19(24-14-26(18)4)23-13-15-9-11-22-12-10-15/h5-14H,1-4H3,(H,25,27)/b23-13+
InChIKey KXPJUQKSGATSDY-YDZHTSKRSA-N
Molecular Weight 361.449 g/mol
SMILES N(C(c1[n](cnc1\N=C\c1ccncc1)C)=O)c1ccc(cc1)C(C)(C)C
SPLASH splash10-03ea-5988000000-ef088d94d136bd7b6454
Synonyms N-(4-tert-butylphenyl)-3-methyl-5-[(E)-4-pyridylmethyleneamino]imidazole-4-carboxamide N-(4-tert-butylphenyl)-3-methyl-5-[(E)-pyridin-4-ylmethylideneamino]-4-imidazolecarboxamide N-(4-tert-butylphenyl)-3-methyl-5-[(E)-pyridin-4-ylmethylideneamino]imidazole-4-carboxamide
Wiley ID 1437797