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2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2-methyl-1H-indol-3-yl)ethanone

View entire compound with spectra: 2 NMR

2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2-methyl-1H-indol-3-yl)ethanone
SpectraBase Compound ID HqEK0ndCBOe
InChI InChI=1S/C18H14N2OS2/c1-11-17(12-6-2-3-7-13(12)19-11)15(21)10-22-18-20-14-8-4-5-9-16(14)23-18/h2-9,19H,10H2,1H3
InChIKey GSMPKHIFWBEPSK-UHFFFAOYSA-N
Mol Weight 338.44 g/mol
Molecular Formula C18H14N2OS2
Exact Mass 338.054755 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FyTSCla9S5m
Name 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(2-methyl-1H-indol-3-yl)ethanone
Comments Computed using HOSE algorithm
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Exact Mass 338.054755426 u
Formula C18H14N2OS2
InChI InChI=1S/C18H14N2OS2/c1-11-17(12-6-2-3-7-13(12)19-11)15(21)10-22-18-20-14-8-4-5-9-16(14)23-18/h2-9,19H,10H2,1H3
InChIKey GSMPKHIFWBEPSK-UHFFFAOYSA-N
Molecular Weight 338.443 g/mol
SMILES N1C2=C(C(=C1C)C(CSC1=NC=3C=CC=CC3S1)=O)C=CC=C2