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(2Z)-2-{4-[(2,6-dichlorobenzyl)oxy]benzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
SpectraBase Compound ID 4cmmAgxjnOX
InChI InChI=1S/C23H14Cl2N2O2S/c24-17-4-3-5-18(25)16(17)13-29-15-10-8-14(9-11-15)12-21-22(28)27-20-7-2-1-6-19(20)26-23(27)30-21/h1-12H,13H2/b21-12-
InChIKey ISCRKWYHENWTTM-MTJSOVHGSA-N
Mol Weight 453.34 g/mol
Molecular Formula C23H14Cl2N2O2S
Exact Mass 452.015304 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtZRImBRrrv
Name (2Z)-2-{4-[(2,6-Dichlorobenzyl)oxy]benzylidene}[1,3]thiazolo[3,2-A]benzimidazol-3(2H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 452.015304271 u
Formula C23H14Cl2N2O2S
InChI InChI=1S/C23H14Cl2N2O2S/c24-17-4-3-5-18(25)16(17)13-29-15-10-8-14(9-11-15)12-21-22(28)27-20-7-2-1-6-19(20)26-23(27)30-21/h1-12H,13H2/b21-12-
InChIKey ISCRKWYHENWTTM-MTJSOVHGSA-N
Molecular Weight 453.343 g/mol
SMILES C1=CC=C2N3C(=NC2=C1)S\C(C3=O)=C\C=1C=CC(OCC2=C(Cl)C=CC=C2Cl)=CC1