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4-(benzo[d]thiazol-2-ylamino)-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-(benzo[d]thiazol-2-ylamino)-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide
SpectraBase Compound ID AhNL2EJ8gJC
InChI InChI=1S/C18H16N4O3S2/c1-11-12(2)21-25-17(11)22-27(23,24)14-9-7-13(8-10-14)19-18-20-15-5-3-4-6-16(15)26-18/h3-10,22H,1-2H3,(H,19,20)
InChIKey VKRFNDWQCGQRTI-UHFFFAOYSA-N
Mol Weight 400.47 g/mol
Molecular Formula C18H16N4O3S2
Exact Mass 400.066383 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID OQvexQEYjm
Name 4-(Benzo[D]thiazol-2-ylamino)-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.066382736 u
Formula C18H16N4O3S2
InChI InChI=1S/C18H16N4O3S2/c1-11-12(2)21-25-17(11)22-27(23,24)14-9-7-13(8-10-14)19-18-20-15-5-3-4-6-16(15)26-18/h3-10,22H,1-2H3,(H,19,20)
InChIKey VKRFNDWQCGQRTI-UHFFFAOYSA-N
Molecular Weight 400.471 g/mol
SMILES C1=CC2=C(C=C1)SC(=N2)NC1=CC=C(C=C1)S(NC=1ON=C(C1C)C)(=O)=O