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6-tert-Butyl-2-[(4-fluorobenzoyl)amino]-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID IwYCm1QKVXR
InChI InChI=1S/C27H26F4N2O2S/c1-26(2,3)16-10-13-18-21(14-16)36-25(33-23(34)15-8-11-17(28)12-9-15)22(18)24(35)32-20-7-5-4-6-19(20)27(29,30)31/h4-9,11-12,16H,10,13-14H2,1-3H3,(H,32,35)(H,33,34)
InChIKey QAKFOIKQLVAHSM-UHFFFAOYSA-N
Mol Weight 518.57 g/mol
Molecular Formula C27H26F4N2O2S
Exact Mass 518.165112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5HC7ZFj5FZ7
Name 6-tert-Butyl-2-[(4-fluorobenzoyl)amino]-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26F4N2O2S
InChI InChI=1S/C27H26F4N2O2S/c1-26(2,3)16-10-13-18-21(14-16)36-25(33-23(34)15-8-11-17(28)12-9-15)22(18)24(35)32-20-7-5-4-6-19(20)27(29,30)31/h4-9,11-12,16H,10,13-14H2,1-3H3,(H,32,35)(H,33,34)
InChIKey QAKFOIKQLVAHSM-UHFFFAOYSA-N
Molecular Weight 518.571 g/mol
SMILES N(c1c(C(Nc2c(C(F)(F)F)cccc2)=O)c2c(s1)CC(CC2)C(C)(C)C)C(c1ccc(cc1)F)=O
SPLASH splash10-00di-2943010000-7cd29bee823eb3480773
Synonyms 6-tert-Butyl-2-[(4-fluorobenzoyl)amino]-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide 6-tert-Butyl-2-[(4-fluorophenyl)carbonylamino]-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 6-tert-Butyl-2-[[(4-fluorophenyl)-oxomethyl]amino]-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Wiley ID 1458810