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N-[3-(acetylamino)phenyl]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide
SpectraBase Compound ID 9X5Bl7i2r0U
InChI InChI=1S/C17H15N3O3S/c1-11(21)18-12-5-4-6-13(9-12)19-16(22)10-24-17-20-14-7-2-3-8-15(14)23-17/h2-9H,10H2,1H3,(H,18,21)(H,19,22)
InChIKey QBFHBMRPLYNPPG-UHFFFAOYSA-N
Mol Weight 341.39 g/mol
Molecular Formula C17H15N3O3S
Exact Mass 341.083413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JnBwLLprNPw
Name N-[3-(Acetylamino)phenyl]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 341.083412526 u
Formula C17H15N3O3S
InChI InChI=1S/C17H15N3O3S/c1-11(21)18-12-5-4-6-13(9-12)19-16(22)10-24-17-20-14-7-2-3-8-15(14)23-17/h2-9H,10H2,1H3,(H,18,21)(H,19,22)
InChIKey QBFHBMRPLYNPPG-UHFFFAOYSA-N
Molecular Weight 341.385 g/mol
SMILES N(C(CSC1=NC=2C=CC=CC2O1)=O)C=1C=C(NC(=O)C)C=CC1