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methyl 6-tert-butyl-2-({[2-(3-methylphenyl)-4-quinolinyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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methyl 6-tert-butyl-2-({[2-(3-methylphenyl)-4-quinolinyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 5TlndEfhJTx
InChI InChI=1S/C31H32N2O3S/c1-18-9-8-10-19(15-18)25-17-23(21-11-6-7-12-24(21)32-25)28(34)33-29-27(30(35)36-5)22-14-13-20(31(2,3)4)16-26(22)37-29/h6-12,15,17,20H,13-14,16H2,1-5H3,(H,33,34)
InChIKey NEFAYDGAOFWVLR-UHFFFAOYSA-N
Mol Weight 512.7 g/mol
Molecular Formula C31H32N2O3S
Exact Mass 512.213364 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9MHJHhG6JgM
Name methyl 6-tert-butyl-2-({[2-(3-methylphenyl)-4-quinolinyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C31H32N2O3S/c1-18-9-8-10-19(15-18)25-17-23(21-11-6-7-12-24(21)32-25)28(34)33-29-27(30(35)36-5)22-14-13-20(31(2,3)4)16-26(22)37-29/h6-12,15,17,20H,13-14,16H2,1-5H3,(H,33,34)
InChIKey NEFAYDGAOFWVLR-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7397
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: UZI/8195889; UBI_ID: UBI-007400
Temperature 313 °C