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2-(benzylthio)-4-(5-chloro-3-methylbenzo[b]thien-2-yl)pyrimidine

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2-(benzylthio)-4-(5-chloro-3-methylbenzo[b]thien-2-yl)pyrimidine
SpectraBase Compound ID 5MgjQnAuaJ9
InChI InChI=1S/C20H15ClN2S2/c1-13-16-11-15(21)7-8-18(16)25-19(13)17-9-10-22-20(23-17)24-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3
InChIKey AXSQNTLEACAWES-UHFFFAOYSA-N
Mol Weight 382.93 g/mol
Molecular Formula C20H15ClN2S2
Exact Mass 382.036519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ebbqmeQwxM
Name 2-(BENZYLTHIO)-4-(5-CHLORO-3-METHYLBENZO[b]THIEN-2-YL)PYRIMIDINE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15ClN2S2
InChI InChI=1S/C20H15ClN2S2/c1-13-16-11-15(21)7-8-18(16)25-19(13)17-9-10-22-20(23-17)24-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3
InChIKey AXSQNTLEACAWES-UHFFFAOYSA-N
Melting Point 137-139C
Molecular Weight 382.94
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms PYRIMIDINE, 2-(BENZYLTHIO)-4-(5-CHLORO-3-METHYLBENZO[b]THIEN-2-YL)-,