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

*Links on SpectraBase are not permalinks.

ethyl 4-(4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-2-oxoethoxy}-3-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

View entire compound with spectra: 2 NMR

ethyl 4-(4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-2-oxoethoxy}-3-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 7dxfdkVtO3l
InChI InChI=1S/C28H31N5O7/c1-6-39-27(36)23-16(2)29-28(37)31-25(23)18-12-13-20(21(14-18)38-5)40-15-22(34)30-24-17(3)32(4)33(26(24)35)19-10-8-7-9-11-19/h7-14,25H,6,15H2,1-5H3,(H,30,34)(H2,29,31,37)
InChIKey KUZUDDCJAJFYCO-UHFFFAOYSA-N
Mol Weight 549.58 g/mol
Molecular Formula C28H31N5O7
Exact Mass 549.222348 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID HCS290sZur5
Name Ethyl 4-(4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-2-oxoethoxy}-3-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 549.222348351 u
Formula C28H31N5O7
InChI InChI=1S/C28H31N5O7/c1-6-39-27(36)23-16(2)29-28(37)31-25(23)18-12-13-20(21(14-18)38-5)40-15-22(34)30-24-17(3)32(4)33(26(24)35)19-10-8-7-9-11-19/h7-14,25H,6,15H2,1-5H3,(H,30,34)(H2,29,31,37)
InChIKey KUZUDDCJAJFYCO-UHFFFAOYSA-N
Molecular Weight 549.584 g/mol
SMILES N(C=1C(N(C2=CC=CC=C2)N(C1C)C)=O)C(COC=1C=CC(C2C(=C(C)NC(N2)=O)C(=O)OCC)=CC1OC)=O