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2-[7-(4-bromo-benzylidene)-3-(4-bromo-phenyl)-3,3a,4,5,6,7-hexahydro-indazol-2-yl]-4-methyl-thiazole-5-carboxylic acid methylamide

View entire compound with spectra: 1 MS (GC)

2-[7-(4-bromo-benzylidene)-3-(4-bromo-phenyl)-3,3a,4,5,6,7-hexahydro-indazol-2-yl]-4-methyl-thiazole-5-carboxylic acid methylamide
SpectraBase Compound ID K8FMS9YRJ1a
InChI InChI=1S/C26H24Br2N4OS/c1-15-24(25(33)29-2)34-26(30-15)32-23(17-8-12-20(28)13-9-17)21-5-3-4-18(22(21)31-32)14-16-6-10-19(27)11-7-16/h6-14,21,23H,3-5H2,1-2H3,(H,29,33)/b18-14+
InChIKey UVWMCTFQLSKOLE-NBVRZTHBSA-N
Mol Weight 600.37 g/mol
Molecular Formula C26H24Br2N4OS
Exact Mass 598.003759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mAQD1JtNw
Name 2-[7-(4-bromo-benzylidene)-3-(4-bromo-phenyl)-3,3a,4,5,6,7-hexahydro-indazol-2-yl]-4-methyl-thiazole-5-carboxylic acid methylamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24Br2N4OS
InChI InChI=1S/C26H24Br2N4OS/c1-15-24(25(33)29-2)34-26(30-15)32-23(17-8-12-20(28)13-9-17)21-5-3-4-18(22(21)31-32)14-16-6-10-19(27)11-7-16/h6-14,21,23H,3-5H2,1-2H3,(H,29,33)/b18-14+
InChIKey UVWMCTFQLSKOLE-NBVRZTHBSA-N
Molecular Weight 600.373 g/mol
SMILES N(C(=O)c1sc(N2C(c3ccc(cc3)Br)C3CCC\C(C3=N2)=C/c2ccc(cc2)Br)nc1C)C
SPLASH splash10-014i-1920000000-15573dc2a17007027c2a
Synonyms 2-[(7E)-7-(4-bromobenzylidene)-3-(4-bromophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-N,4-dimethyl-1,3-thiazole-5-carboxamide 2-[7-(4-bromobenzylidene)-3-(4-bromophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-n,4-dimethyl-1,3-thiazole-5-carboxamide
Wiley ID 1463810