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benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-6-methyl-2-[[[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]acetyl]amino]-, methyl ester

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benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-6-methyl-2-[[[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]acetyl]amino]-, methyl ester
SpectraBase Compound ID CAI4cOkf5TW
InChI InChI=1S/C24H24N4O3S2/c1-13-8-9-16-18(10-13)33-22(21(16)23(30)31-3)25-20(29)12-32-24-27-26-19-11-14(2)15-6-4-5-7-17(15)28(19)24/h4-7,11,13H,8-10,12H2,1-3H3,(H,25,29)
InChIKey VZTIEFIZIBLKEK-UHFFFAOYSA-N
Mol Weight 480.6 g/mol
Molecular Formula C24H24N4O3S2
Exact Mass 480.128983 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FeYCZJ2i97i
Name benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-6-methyl-2-[[[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]acetyl]amino]-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H24N4O3S2/c1-13-8-9-16-18(10-13)33-22(21(16)23(30)31-3)25-20(29)12-32-24-27-26-19-11-14(2)15-6-4-5-7-17(15)28(19)24/h4-7,11,13H,8-10,12H2,1-3H3,(H,25,29)
InChIKey VZTIEFIZIBLKEK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_739
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11228418