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acetamide, N-[4-[[4-(2-furanylcarbonyl)-1-piperazinyl]sulfonyl]phenyl]-
SpectraBase Compound ID De9aaiEdmu5
InChI InChI=1S/C17H19N3O5S/c1-13(21)18-14-4-6-15(7-5-14)26(23,24)20-10-8-19(9-11-20)17(22)16-3-2-12-25-16/h2-7,12H,8-11H2,1H3,(H,18,21)
InChIKey QCCJGASCIQWJHN-UHFFFAOYSA-N
Mol Weight 377.42 g/mol
Molecular Formula C17H19N3O5S
Exact Mass 377.104542 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hUbcwMqDLS
Name Acetamide, N-[4-[[4-(2-furanylcarbonyl)-1-piperazinyl]sulfonyl]phenyl]-
Comments Computed using HOSE algorithm
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Exact Mass 377.104541893 u
Formula C17H19N3O5S
InChI InChI=1S/C17H19N3O5S/c1-13(21)18-14-4-6-15(7-5-14)26(23,24)20-10-8-19(9-11-20)17(22)16-3-2-12-25-16/h2-7,12H,8-11H2,1H3,(H,18,21)
InChIKey QCCJGASCIQWJHN-UHFFFAOYSA-N
Molecular Weight 377.415 g/mol
SMILES N(C(=O)C)C=1C=CC(S(N2CCN(C(C=3OC=CC3)=O)CC2)(=O)=O)=CC1