For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-{[4-(1,3-benzodioxol-5-yl)-6-oxo-1-phenyl-1,6-dihydro-2-pyrimidinyl]sulfanyl}-N-isopropyl-N-phenylacetamide
SpectraBase Compound ID Dp9IK5ugJWb
InChI InChI=1S/C28H25N3O4S/c1-19(2)30(21-9-5-3-6-10-21)27(33)17-36-28-29-23(20-13-14-24-25(15-20)35-18-34-24)16-26(32)31(28)22-11-7-4-8-12-22/h3-16,19H,17-18H2,1-2H3
InChIKey XOZWEIHJVWJGLD-UHFFFAOYSA-N
Mol Weight 499.59 g/mol
Molecular Formula C28H25N3O4S
Exact Mass 499.156577 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID F0RC21iytUT
Name 2-{[4-(1,3-benzodioxol-5-yl)-6-oxo-1-phenyl-1,6-dihydro-2-pyrimidinyl]sulfanyl}-N-isopropyl-N-phenylacetamide
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/C28H25N3O4S/c1-19(2)30(21-9-5-3-6-10-21)27(33)17-36-28-29-23(20-13-14-24-25(15-20)35-18-34-24)16-26(32)31(28)22-11-7-4-8-12-22/h3-16,19H,17-18H2,1-2H3
InChIKey XOZWEIHJVWJGLD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16397
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: 987/00003762; Labnumber: 987/00003762218845; VK_ID: VK-016402
Temperature 318 °C