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1-Ethyl-8-[(5-fluoro-6-methoxy-2-benzimidazolyl)thiomethyl]-4-[N-(2-hydroxyethyl)-N-methylamino]-1,2,3,4-tetrahydroquinoline

View entire compound with spectra: 1 MS (GC)

1-Ethyl-8-[(5-fluoro-6-methoxy-2-benzimidazolyl)thiomethyl]-4-[N-(2-hydroxyethyl)-N-methylamino]-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID xxd0IEij6c
InChI InChI=1S/C23H29FN4O2S/c1-4-28-9-8-20(27(2)10-11-29)16-7-5-6-15(22(16)28)14-31-23-25-18-12-17(24)21(30-3)13-19(18)26-23/h5-7,12-13,20,29H,4,8-11,14H2,1-3H3,(H,25,26)
InChIKey LMRIVWKODHNPOT-UHFFFAOYSA-N
Mol Weight 444.57 g/mol
Molecular Formula C23H29FN4O2S
Exact Mass 444.199526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWIdPGhg5LE
Name 1-Ethyl-8-[(5-fluoro-6-methoxy-2-benzimidazolyl)thiomethyl]-4-[N-(2-hydroxyethyl)-N-methylamino]-1,2,3,4-tetrahydroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29FN4O2S
InChI InChI=1S/C23H29FN4O2S/c1-4-28-9-8-20(27(2)10-11-29)16-7-5-6-15(22(16)28)14-31-23-25-18-12-17(24)21(30-3)13-19(18)26-23/h5-7,12-13,20,29H,4,8-11,14H2,1-3H3,(H,25,26)
InChIKey LMRIVWKODHNPOT-UHFFFAOYSA-N
Molecular Weight 444.569 g/mol
SMILES [nH]1c2c(nc1SCc1cccc3c1N(CCC3N(CCO)C)CC)cc(c(c2)OC)F
SPLASH splash10-0f79-2900000000-3b87d6109f29bd46bc01
Source of Spectrum E1-38-1585-16
Synonyms 2-[(1-ethyl-8-{[(5-fluoro-6-methoxy-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,3,4-tetrahydro-4-quinolinyl)(methyl)amino]ethanol
Wiley ID 1518390