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N,N'-bis[2-Benzothiazolyl]terephthalamide
SpectraBase Compound ID 18UERRaruS8
InChI InChI=1S/C22H14N4O2S2/c27-19(25-21-23-15-5-1-3-7-17(15)29-21)13-9-11-14(12-10-13)20(28)26-22-24-16-6-2-4-8-18(16)30-22/h1-12H,(H,23,25,27)(H,24,26,28)
InChIKey BVBOESFFOAOBDG-UHFFFAOYSA-N
Mol Weight 430.5 g/mol
Molecular Formula C22H14N4O2S2
Exact Mass 430.055818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4UbhZKGLKJV
Name N,N'-bis[2-Benzothiazolyl]terephthalamide
Comments Computed using HOSE algorithm
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Exact Mass 430.055818053 u
Formula C22H14N4O2S2
InChI InChI=1S/C22H14N4O2S2/c27-19(25-21-23-15-5-1-3-7-17(15)29-21)13-9-11-14(12-10-13)20(28)26-22-24-16-6-2-4-8-18(16)30-22/h1-12H,(H,23,25,27)(H,24,26,28)
InChIKey BVBOESFFOAOBDG-UHFFFAOYSA-N
Molecular Weight 430.500 g/mol
SMILES C1(=NC2=C(S1)C=CC=C2)NC(=O)C1=CC=C(C=C1)C(=O)NC=1SC2=C(N1)C=CC=C2