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N-benzyl-N'-{[2-(3-isopropoxyphenyl)-4-quinolinyl]carbonyl}-N-phenylthiourea
SpectraBase Compound ID EL9y9TDAFfG
InChI InChI=1S/C33H29N3O2S/c1-23(2)38-27-17-11-14-25(20-27)31-21-29(28-18-9-10-19-30(28)34-31)32(37)35-33(39)36(26-15-7-4-8-16-26)22-24-12-5-3-6-13-24/h3-21,23H,22H2,1-2H3,(H,35,37,39)
InChIKey WYBPNBFETKLAOB-UHFFFAOYSA-N
Mol Weight 531.7 g/mol
Molecular Formula C33H29N3O2S
Exact Mass 531.198048 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B3uI1vbSBCC
Name N-benzyl-N'-{[2-(3-isopropoxyphenyl)-4-quinolinyl]carbonyl}-N-phenylthiourea
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/C33H29N3O2S/c1-23(2)38-27-17-11-14-25(20-27)31-21-29(28-18-9-10-19-30(28)34-31)32(37)35-33(39)36(26-15-7-4-8-16-26)22-24-12-5-3-6-13-24/h3-21,23H,22H2,1-2H3,(H,35,37,39)
InChIKey WYBPNBFETKLAOB-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16207
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/9686452; Labnumber: OBM0309; UZI_ID: UZI-016211
Temperature 308 °C