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S-(2-{[(2,3-dichloroanilino)carbonyl]sulfanyl}ethyl) 2,3-dichlorophenylthiocarbamate

View entire compound with spectra: 2 NMR

S-(2-{[(2,3-dichloroanilino)carbonyl]sulfanyl}ethyl) 2,3-dichlorophenylthiocarbamate
SpectraBase Compound ID EcjGMxf3x47
InChI InChI=1S/C16H12Cl4N2O2S2/c17-9-3-1-5-11(13(9)19)21-15(23)25-7-8-26-16(24)22-12-6-2-4-10(18)14(12)20/h1-6H,7-8H2,(H,21,23)(H,22,24)
InChIKey CQJAEVBEWFNLCD-UHFFFAOYSA-N
Mol Weight 470.2 g/mol
Molecular Formula C16H12Cl4N2O2S2
Exact Mass 467.909431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6heucTKYjFS
Name S-(2-{[(2,3-dichloroanilino)carbonyl]sulfanyl}ethyl) 2,3-dichlorophenylthiocarbamate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 467.909430780 u
Formula C16H12Cl4N2O2S2
InChI InChI=1S/C16H12Cl4N2O2S2/c17-9-3-1-5-11(13(9)19)21-15(23)25-7-8-26-16(24)22-12-6-2-4-10(18)14(12)20/h1-6H,7-8H2,(H,21,23)(H,22,24)
InChIKey CQJAEVBEWFNLCD-UHFFFAOYSA-N
Molecular Weight 470.216 g/mol
SMILES N(C(SCCSC(NC1=C(C(Cl)=CC=C1)Cl)=O)=O)C=1C(=C(Cl)C=CC1)Cl