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

*Links on SpectraBase are not permalinks.

3-quinazolinepropanamide, N-(3,5-dimethylphenyl)-1,2,3,4-tetrahydro-4-oxo-2-thioxo-

View entire compound with spectra: 2 NMR

3-quinazolinepropanamide, N-(3,5-dimethylphenyl)-1,2,3,4-tetrahydro-4-oxo-2-thioxo-
SpectraBase Compound ID FMRqUsFFwcM
InChI InChI=1S/C19H19N3O2S/c1-12-9-13(2)11-14(10-12)20-17(23)7-8-22-18(24)15-5-3-4-6-16(15)21-19(22)25/h3-6,9-11H,7-8H2,1-2H3,(H,20,23)(H,21,25)
InChIKey OCCCLIBELNXGFN-UHFFFAOYSA-N
Mol Weight 353.44 g/mol
Molecular Formula C19H19N3O2S
Exact Mass 353.119798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID OD6vvJHEUx
Name 3-Quinazolinepropanamide, N-(3,5-dimethylphenyl)-1,2,3,4-tetrahydro-4-oxo-2-thioxo-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.119798036 u
Formula C19H19N3O2S
InChI InChI=1S/C19H19N3O2S/c1-12-9-13(2)11-14(10-12)20-17(23)7-8-22-18(24)15-5-3-4-6-16(15)21-19(22)25/h3-6,9-11H,7-8H2,1-2H3,(H,20,23)(H,21,25)
InChIKey OCCCLIBELNXGFN-UHFFFAOYSA-N
Molecular Weight 353.440 g/mol
SMILES N1C=2C(C(N(CCC(NC3=CC(C)=CC(=C3)C)=O)C1=S)=O)=CC=CC2