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N-[4-(benzyloxy)phenyl]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
SpectraBase Compound ID BAh3koESFLq
InChI InChI=1S/C32H29N3O4S2/c1-38-24-17-13-23(14-18-24)35-31(37)29-26-9-5-6-10-27(26)41-30(29)34-32(35)40-20-28(36)33-22-11-15-25(16-12-22)39-19-21-7-3-2-4-8-21/h2-4,7-8,11-18H,5-6,9-10,19-20H2,1H3,(H,33,36)
InChIKey ULLGVUZKDVZMJM-UHFFFAOYSA-N
Mol Weight 583.7 g/mol
Molecular Formula C32H29N3O4S2
Exact Mass 583.159949 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1YVzZ4oLNSn
Name N-[4-(benzyloxy)phenyl]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
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/C32H29N3O4S2/c1-38-24-17-13-23(14-18-24)35-31(37)29-26-9-5-6-10-27(26)41-30(29)34-32(35)40-20-28(36)33-22-11-15-25(16-12-22)39-19-21-7-3-2-4-8-21/h2-4,7-8,11-18H,5-6,9-10,19-20H2,1H3,(H,33,36)
InChIKey ULLGVUZKDVZMJM-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17113
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: D25531; Labnumber: GRES-04609; SBI_ID: SBI-017116
Temperature 308 °C