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Benzenesulfonamide, 4-[(3-chloro-1,4-dioxo-2-naphthyl)amino]-N-(2-pyrimdinyl)-
SpectraBase Compound ID 62JNyJhR0f9
InChI InChI=1S/C20H13ClN4O4S/c21-16-17(19(27)15-5-2-1-4-14(15)18(16)26)24-12-6-8-13(9-7-12)30(28,29)25-20-22-10-3-11-23-20/h1-11,24H,(H,22,23,25)
InChIKey POTUAHSZNGYDPG-UHFFFAOYSA-N
Mol Weight 440.86 g/mol
Molecular Formula C20H13ClN4O4S
Exact Mass 440.034604 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7VIPwIBsqZ7
Name Benzenesulfonamide, 4-[(3-chloro-1,4-dioxo-2-naphthyl)amino]-N-(2-pyrimdinyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 440.034603785 u
Formula C20H13ClN4O4S
InChI InChI=1S/C20H13ClN4O4S/c21-16-17(19(27)15-5-2-1-4-14(15)18(16)26)24-12-6-8-13(9-7-12)30(28,29)25-20-22-10-3-11-23-20/h1-11,24H,(H,22,23,25)
InChIKey POTUAHSZNGYDPG-UHFFFAOYSA-N
Molecular Weight 440.861 g/mol
SMILES C1(S(=O)(=O)NC=2N=CC=CN2)=CC=C(C=C1)NC1=C(Cl)C(=O)C=2C(C1=O)=CC=CC2