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1H-pyrazole-3-carboxamide, 4-[2-(3-butyl-5-chloro-2(3H)-benzoxazolylidene)ethylidene]-N-hexyl-4,5-dihydro-5-oxo-1-phenyl-
SpectraBase Compound ID EQAPz3Yky8v
InChI InChI=1S/C29H33ClN4O3/c1-3-5-7-11-18-31-28(35)27-23(29(36)34(32-27)22-12-9-8-10-13-22)15-17-26-33(19-6-4-2)24-20-21(30)14-16-25(24)37-26/h8-10,12-17,20H,3-7,11,18-19H2,1-2H3,(H,31,35)/b23-15-,26-17-
InChIKey PWDMQMMAYAJEHO-QCKZHHHPSA-N
Mol Weight 521.1 g/mol
Molecular Formula C29H33ClN4O3
Exact Mass 520.224119 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C71loXBmlDr
Name 1H-pyrazole-3-carboxamide, 4-[2-(3-butyl-5-chloro-2(3H)-benzoxazolylidene)ethylidene]-N-hexyl-4,5-dihydro-5-oxo-1-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H33ClN4O3
InChI InChI=1S/C29H33ClN4O3/c1-3-5-7-11-18-31-28(35)27-23(29(36)34(32-27)22-12-9-8-10-13-22)15-17-26-33(19-6-4-2)24-20-21(30)14-16-25(24)37-26/h8-10,12-17,20H,3-7,11,18-19H2,1-2H3,(H,31,35)/b23-15-,26-17-
InChIKey PWDMQMMAYAJEHO-QCKZHHHPSA-N
Molecular Weight 521.061 g/mol
SMILES N(CCCCCC)C(=O)C1=NN(C(=O)\C1=C\C=C/1Oc2ccc(Cl)cc2N1CCCC)c1ccccc1
SPLASH splash10-00di-7134090000-7f5c1a64cb92e1b0ab44
Source of Spectrum JX-2015-4-1048
Synonyms 4-(2-(3-butyl-5-chlorobenzo[d]oxazol-2(3H)-ylidene)ethylidene)-N-hexyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazole-3-carboxamide 4-[2-(3-butyl-5-chloro-1,3-benzoxazol-2-ylidene)ethylidene]-N-hexyl-5-oxo-1-phenyl-3-pyrazolecarboxamide 4-[2-(3-butyl-5-chloro-1,3-benzoxazol-2-ylidene)ethylidene]-N-hexyl-5-oxo-1-phenylpyrazole-3-carboxamide 4-[2-(3-butyl-5-chloro-1,3-benzoxazol-2-ylidene)ethylidene]-N-hexyl-5-oxo-1-phenyl-pyrazole-3-carboxamide 4-[2-(3-butyl-5-chloranyl-1,3-benzoxazol-2-ylidene)ethylidene]-N-hexyl-5-oxidanylidene-1-phenyl-pyrazole-3-carboxamide
Wiley ID 1726451