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Benzenesulfonamide, 2-chloro-N-[[[4-chloro-6-(4-chlorophenoxy)-1,3,5-triazin-2-yl]amino]carbonyl]-
SpectraBase Compound ID B2LdESRwbC2
InChI InChI=1S/C16H10Cl3N5O4S/c17-9-5-7-10(8-6-9)28-16-21-13(19)20-14(23-16)22-15(25)24-29(26,27)12-4-2-1-3-11(12)18/h1-8H,(H2,20,21,22,23,24,25)
InChIKey FVFWLGPMRCVWED-UHFFFAOYSA-N
Mol Weight 474.71 g/mol
Molecular Formula C16H10Cl3N5O4S
Exact Mass 472.951908 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B4Tio9yXINE
Name Benzenesulfonamide, 2-chloro-N-[[[4-chloro-6-(4-chlorophenoxy)-1,3,5-triazin-2-yl]amino]carbonyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.951908092 u
Formula C16H10Cl3N5O4S
InChI InChI=1S/C16H10Cl3N5O4S/c17-9-5-7-10(8-6-9)28-16-21-13(19)20-14(23-16)22-15(25)24-29(26,27)12-4-2-1-3-11(12)18/h1-8H,(H2,20,21,22,23,24,25)
InChIKey FVFWLGPMRCVWED-UHFFFAOYSA-N
Molecular Weight 474.706 g/mol
SMILES N(C=1N=C(N=C(N1)OC1=CC=C(C=C1)Cl)Cl)C(NS(=O)(=O)C1=CC=CC=C1Cl)=O