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

*Links on SpectraBase are not permalinks.
5-Thiazolecarboxylic acid, 4-methyl-2-[[3-(phenylmethoxy)benzoyl]amino]-, methyl ester
SpectraBase Compound ID 2301N2lnPda
InChI InChI=1S/C20H18N2O4S/c1-13-17(19(24)25-2)27-20(21-13)22-18(23)15-9-6-10-16(11-15)26-12-14-7-4-3-5-8-14/h3-11H,12H2,1-2H3,(H,21,22,23)
InChIKey NNRJLPJVSMVIIJ-UHFFFAOYSA-N
Mol Weight 382.43 g/mol
Molecular Formula C20H18N2O4S
Exact Mass 382.098728 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 DQB7tqDYivP
Name 5-Thiazolecarboxylic acid, 4-methyl-2-[[3-(phenylmethoxy)benzoyl]amino]-, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.098728238 u
Formula C20H18N2O4S
InChI InChI=1S/C20H18N2O4S/c1-13-17(19(24)25-2)27-20(21-13)22-18(23)15-9-6-10-16(11-15)26-12-14-7-4-3-5-8-14/h3-11H,12H2,1-2H3,(H,21,22,23)
InChIKey NNRJLPJVSMVIIJ-UHFFFAOYSA-N
Molecular Weight 382.434 g/mol
SMILES N(C=1SC(=C(N1)C)C(=O)OC)C(C=1C=C(OCC=2C=CC=CC2)C=CC1)=O