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1H-pyrazole-3-carboxamide, 4-[2-(3-butyl-5-chloro-2(3H)-benzoxazolylidene)ethylidene]-N-cyclohexyl-N-ethyl-4,5-dihydro-5-oxo-1-phenyl-
SpectraBase Compound ID EqmvFe1gDP1
InChI InChI=1S/C31H35ClN4O3/c1-3-5-20-35-26-21-22(32)16-18-27(26)39-28(35)19-17-25-29(31(38)34(4-2)23-12-8-6-9-13-23)33-36(30(25)37)24-14-10-7-11-15-24/h7,10-11,14-19,21,23H,3-6,8-9,12-13,20H2,1-2H3/b25-17-,28-19-
InChIKey AVHCJRCNPNOQEV-UXXYHWAYSA-N
Mol Weight 547.1 g/mol
Molecular Formula C31H35ClN4O3
Exact Mass 546.239769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2omSlGBPFo
Name 1H-pyrazole-3-carboxamide, 4-[2-(3-butyl-5-chloro-2(3H)-benzoxazolylidene)ethylidene]-N-cyclohexyl-N-ethyl-4,5-dihydro-5-oxo-1-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H35ClN4O3
InChI InChI=1S/C31H35ClN4O3/c1-3-5-20-35-26-21-22(32)16-18-27(26)39-28(35)19-17-25-29(31(38)34(4-2)23-12-8-6-9-13-23)33-36(30(25)37)24-14-10-7-11-15-24/h7,10-11,14-19,21,23H,3-6,8-9,12-13,20H2,1-2H3/b25-17-,28-19-
InChIKey AVHCJRCNPNOQEV-UXXYHWAYSA-N
Molecular Weight 547.099 g/mol
SMILES CCCCN1\C(Oc2ccc(Cl)cc12)=C\C=C/1C(=O)N(N=C1C(=O)N(CC)C1CCCCC1)c1ccccc1
SPLASH splash10-004j-9523030000-2d7baf39284f030e6b96
Source of Spectrum JX-2015-4-1156
Synonyms 4-(2-(3-butyl-5-chlorobenzo[d]oxazol-2(3H)-ylidene)ethylidene)-N-cyclohexyl-N-ethyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazole-3-carboxamide 4-[2-(3-butyl-5-chloro-1,3-benzoxazol-2-ylidene)ethylidene]-N-cyclohexyl-N-ethyl-5-oxo-1-phenyl-3-pyrazolecarboxamide 4-[2-(3-butyl-5-chloro-1,3-benzoxazol-2-ylidene)ethylidene]-N-cyclohexyl-N-ethyl-5-oxo-1-phenylpyrazole-3-carboxamide 4-[2-(3-butyl-5-chloro-1,3-benzoxazol-2-ylidene)ethylidene]-N-cyclohexyl-N-ethyl-5-oxo-1-phenyl-pyrazole-3-carboxamide 4-[2-(3-butyl-5-chloranyl-1,3-benzoxazol-2-ylidene)ethylidene]-N-cyclohexyl-N-ethyl-5-oxidanylidene-1-phenyl-pyrazole-3-carboxamide
Wiley ID 1726550