For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Benzothiophene-3-carboxylic acid, 2-[[[2-[(4-fluorophenyl)sulfonyl]-1,2,3,4-tetrahydro-3-isoquinolinyl]carbonyl]amino]-4,5,6,7-tetrahydro-, ethyl ester
SpectraBase Compound ID DfHQXDqA3iu
InChI InChI=1S/C27H27FN2O5S2/c1-2-35-27(32)24-21-9-5-6-10-23(21)36-26(24)29-25(31)22-15-17-7-3-4-8-18(17)16-30(22)37(33,34)20-13-11-19(28)12-14-20/h3-4,7-8,11-14,22H,2,5-6,9-10,15-16H2,1H3,(H,29,31)
InChIKey OFSZOBQFQWGLIV-UHFFFAOYSA-N
Mol Weight 542.64 g/mol
Molecular Formula C27H27FN2O5S2
Exact Mass 542.134542 g/mol
  • Ethyl 2-[[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
  • Ethyl 2-[[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
  • Ethyl 2-[[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
  • 2-[[[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.