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methyl 2-[({1-[(4-bromo-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 1xzIXgOgo3S
InChI InChI=1S/C22H26BrN5O3S/c1-22(2,3)13-5-6-15-17(9-13)32-20(18(15)21(30)31-4)25-19(29)16-7-8-27(26-16)12-28-11-14(23)10-24-28/h7-8,10-11,13H,5-6,9,12H2,1-4H3,(H,25,29)
InChIKey JNSLPQSQYVVPMU-UHFFFAOYSA-N
Mol Weight 520.45 g/mol
Molecular Formula C22H26BrN5O3S
Exact Mass 519.093974 g/mol
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Solvent DMSO-d6
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