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N-[4-(Acridin-9-ylamino)-phenyl]-4-methyl-benzenesulfonamide
SpectraBase Compound ID AgtsyqEhR6c
InChI InChI=1S/C26H21N3O2S/c1-18-10-16-21(17-11-18)32(30,31)29-20-14-12-19(13-15-20)27-26-22-6-2-4-8-24(22)28-25-9-5-3-7-23(25)26/h2-17,29H,1H3,(H,27,28)
InChIKey TUBFFHNGKOTETL-UHFFFAOYSA-N
Mol Weight 439.53 g/mol
Molecular Formula C26H21N3O2S
Exact Mass 439.135448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ZRu8ufknyW
Name N-[4-(Acridin-9-ylamino)-phenyl]-4-methyl-benzenesulfonamide
Comments Computed using HOSE algorithm
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Exact Mass 439.135448100 u
Formula C26H21N3O2S
InChI InChI=1S/C26H21N3O2S/c1-18-10-16-21(17-11-18)32(30,31)29-20-14-12-19(13-15-20)27-26-22-6-2-4-8-24(22)28-25-9-5-3-7-23(25)26/h2-17,29H,1H3,(H,27,28)
InChIKey TUBFFHNGKOTETL-UHFFFAOYSA-N
Molecular Weight 439.533 g/mol
SMILES C1(NS(C2=CC=C(C=C2)C)(=O)=O)=CC=C(NC2=C3C(C=CC=C3)=NC3=C2C=CC=C3)C=C1