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

*Links on SpectraBase are not permalinks.
4-(1,3-benzothiazol-2-yl)-N-[[2-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl]aniline
SpectraBase Compound ID 5qZ71iJmq4x
InChI InChI=1S/C29H25ClN2O2S/c1-2-33-26-12-7-9-21(28(26)34-19-22-8-3-4-10-24(22)30)18-31-23-16-14-20(15-17-23)29-32-25-11-5-6-13-27(25)35-29/h3-17,31H,2,18-19H2,1H3
InChIKey LNYAPKWIMHSPCZ-UHFFFAOYSA-N
Mol Weight 501.04 g/mol
Molecular Formula C29H25ClN2O2S
Exact Mass 500.132527 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 Jd5yZbyQGPW
Name 4-(1,3-Benzothiazol-2-yl)-N-[[2-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl]aniline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 500.132526925 u
Formula C29H25ClN2O2S
InChI InChI=1S/C29H25ClN2O2S/c1-2-33-26-12-7-9-21(28(26)34-19-22-8-3-4-10-24(22)30)18-31-23-16-14-20(15-17-23)29-32-25-11-5-6-13-27(25)35-29/h3-17,31H,2,18-19H2,1H3
InChIKey LNYAPKWIMHSPCZ-UHFFFAOYSA-N
Molecular Weight 501.044 g/mol
SMILES C1(=NC=2C=CC=CC2S1)C=1C=CC(NCC2=C(OCC=3C(Cl)=CC=CC3)C(OCC)=CC=C2)=CC1