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2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-ethoxy-1,3-benzothiazole

View entire compound with spectra: 2 NMR

2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-ethoxy-1,3-benzothiazole
SpectraBase Compound ID 2NmzytQKwbq
InChI InChI=1S/C17H15N3OS2/c1-2-21-11-7-8-14-15(9-11)23-17(20-14)22-10-16-18-12-5-3-4-6-13(12)19-16/h3-9H,2,10H2,1H3,(H,18,19)
InChIKey IJRAECOGSBNVOX-UHFFFAOYSA-N
Mol Weight 341.45 g/mol
Molecular Formula C17H15N3OS2
Exact Mass 341.065654 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7MOAjIv8LMG
Name 2-[(1H-Benzimidazol-2-ylmethyl)sulfanyl]-6-ethoxy-1,3-benzothiazole
Comments Computed using HOSE algorithm
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Exact Mass 341.065654462 u
Formula C17H15N3OS2
InChI InChI=1S/C17H15N3OS2/c1-2-21-11-7-8-14-15(9-11)23-17(20-14)22-10-16-18-12-5-3-4-6-13(12)19-16/h3-9H,2,10H2,1H3,(H,18,19)
InChIKey IJRAECOGSBNVOX-UHFFFAOYSA-N
Molecular Weight 341.447 g/mol
SMILES N1C=2C=CC=CC2N=C1CSC1=NC=2C=CC(=CC2S1)OCC