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N-[3-(aminocarbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothien-2-yl]-2-(2-thienyl)-4-quinolinecarboxamide
SpectraBase Compound ID Giro15fzR14
InChI InChI=1S/C27H27N3O2S2/c1-27(2,3)15-10-11-17-22(13-15)34-26(23(17)24(28)31)30-25(32)18-14-20(21-9-6-12-33-21)29-19-8-5-4-7-16(18)19/h4-9,12,14-15H,10-11,13H2,1-3H3,(H2,28,31)(H,30,32)
InChIKey OQPXYOCLWMRYMS-UHFFFAOYSA-N
Mol Weight 489.65 g/mol
Molecular Formula C27H27N3O2S2
Exact Mass 489.154469 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6srKpeAm8S9
Name N-[3-(aminocarbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothien-2-yl]-2-(2-thienyl)-4-quinolinecarboxamide
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/C27H27N3O2S2/c1-27(2,3)15-10-11-17-22(13-15)34-26(23(17)24(28)31)30-25(32)18-14-20(21-9-6-12-33-21)29-19-8-5-4-7-16(18)19/h4-9,12,14-15H,10-11,13H2,1-3H3,(H2,28,31)(H,30,32)
InChIKey OQPXYOCLWMRYMS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7768
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: UZI/9011149; UBI_ID: UBI-007771
Temperature 318 °C