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benzenesulfonamide, N-[5-amino-1-[4-(4-methylphenyl)-2-thiazolyl]-1H-1,2,4-triazol-3-yl]-4-methyl-
SpectraBase Compound ID 5he7Ur4O35K
InChI InChI=1S/C19H18N6O2S2/c1-12-3-7-14(8-4-12)16-11-28-19(21-16)25-17(20)22-18(23-25)24-29(26,27)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H3,20,22,23,24)
InChIKey SDRBGPRJQLWUQX-UHFFFAOYSA-N
Mol Weight 426.51 g/mol
Molecular Formula C19H18N6O2S2
Exact Mass 426.093266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bMhh6OO9Xe
Name Benzenesulfonamide, N-[5-amino-1-[4-(4-methylphenyl)-2-thiazolyl]-1H-1,2,4-triazol-3-yl]-4-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.093266190 u
Formula C19H18N6O2S2
InChI InChI=1S/C19H18N6O2S2/c1-12-3-7-14(8-4-12)16-11-28-19(21-16)25-17(20)22-18(23-25)24-29(26,27)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H3,20,22,23,24)
InChIKey SDRBGPRJQLWUQX-UHFFFAOYSA-N
Molecular Weight 426.513 g/mol
SMILES N(S(C1=CC=C(C=C1)C)(=O)=O)C=1N=C(N(N1)C1=NC(C2=CC=C(C=C2)C)=CS1)N