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N-(4-methoxyphenyl)-4-{[(1-naphthylamino)carbonyl]amino}benzenesulfonamide
SpectraBase Compound ID HD6VNeN6Ehp
InChI InChI=1S/C24H21N3O4S/c1-31-20-13-9-19(10-14-20)27-32(29,30)21-15-11-18(12-16-21)25-24(28)26-23-8-4-6-17-5-2-3-7-22(17)23/h2-16,27H,1H3,(H2,25,26,28)
InChIKey QZQWNRBIKHBPBQ-UHFFFAOYSA-N
Mol Weight 447.51 g/mol
Molecular Formula C24H21N3O4S
Exact Mass 447.125277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dx0Xw3ta9XG
Name N-(4-Methoxyphenyl)-4-{[(1-naphthylamino)carbonyl]amino}benzenesulfonamide
Comments Computed using HOSE algorithm
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Exact Mass 447.125277338 u
Formula C24H21N3O4S
InChI InChI=1S/C24H21N3O4S/c1-31-20-13-9-19(10-14-20)27-32(29,30)21-15-11-18(12-16-21)25-24(28)26-23-8-4-6-17-5-2-3-7-22(17)23/h2-16,27H,1H3,(H2,25,26,28)
InChIKey QZQWNRBIKHBPBQ-UHFFFAOYSA-N
Molecular Weight 447.509 g/mol
SMILES N(C(=O)NC1=CC=C(S(NC2=CC=C(OC)C=C2)(=O)=O)C=C1)C1=C2C(C=CC=C2)=CC=C1