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2-(Ethyl-phenyl-amino)-N-(7-oxo-4,5,6,7-tetrahydro-benzothiazol-2-yl)-acetamide
SpectraBase Compound ID 9gKoBOAnYWW
InChI InChI=1S/C17H19N3O2S/c1-2-20(12-7-4-3-5-8-12)11-15(22)19-17-18-13-9-6-10-14(21)16(13)23-17/h3-5,7-8H,2,6,9-11H2,1H3,(H,18,19,22)
InChIKey CJWBEQPABYJZHP-UHFFFAOYSA-N
Mol Weight 329.42 g/mol
Molecular Formula C17H19N3O2S
Exact Mass 329.119798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7bQVxBplEl
Name 2-(Ethyl-phenyl-amino)-N-(7-oxo-4,5,6,7-tetrahydro-benzothiazol-2-yl)-acetamide
Comments Computed using HOSE algorithm
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Exact Mass 329.119798036 u
Formula C17H19N3O2S
InChI InChI=1S/C17H19N3O2S/c1-2-20(12-7-4-3-5-8-12)11-15(22)19-17-18-13-9-6-10-14(21)16(13)23-17/h3-5,7-8H,2,6,9-11H2,1H3,(H,18,19,22)
InChIKey CJWBEQPABYJZHP-UHFFFAOYSA-N
Molecular Weight 329.418 g/mol
SMILES C1(=NC=2CCCC(C2S1)=O)NC(CN(C1=CC=CC=C1)CC)=O