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1-(2,5-Dithia-7-aza-bicyclo[2.2.1]hept-7-yl)-3-(2-pyridin-2-yl-ethyl)-thiourea
SpectraBase Compound ID At7n6Y0AVc8
InChI InChI=1S/C12H16N4S3/c17-12(14-6-4-9-3-1-2-5-13-9)15-16-10-7-18-11(16)8-19-10/h1-3,5,10-11H,4,6-8H2,(H2,14,15,17)/t10-,11-/m1/s1
InChIKey XPXDSENBLIPMNM-GHMZBOCLSA-N
Mol Weight 312.47 g/mol
Molecular Formula C12H16N4S3
Exact Mass 312.05371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmrLeG0BJHo
Name 1-(2,5-Dithia-7-aza-bicyclo[2.2.1]hept-7-yl)-3-(2-pyridin-2-yl-ethyl)-thiourea
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Formula C12H16N4S3
InChI InChI=1S/C12H16N4S3/c17-12(14-6-4-9-3-1-2-5-13-9)15-16-10-7-18-11(16)8-19-10/h1-3,5,10-11H,4,6-8H2,(H2,14,15,17)/t10-,11-/m1/s1
InChIKey XPXDSENBLIPMNM-GHMZBOCLSA-N
Molecular Weight 312.468 g/mol
SMILES N(C(NN1[C@@]2(SC[C@]1(SC2)[H])[H])=S)CCc1ncccc1
SPLASH splash10-0aor-6931000000-67dcb3dbbde6c5ce5aec
Synonyms 1-(2,5-dithia-7-azabicyclo[2.2.1]heptan-7-yl)-3-(2-pyridin-2-ylethyl)thiourea 1-(2,5-dithia-7-azabicyclo[2.2.1]heptan-7-yl)-3-[2-(2-pyridinyl)ethyl]thiourea 1-(2,5-dithia-7-azabicyclo[2.2.1]heptan-7-yl)-3-[2-(2-pyridyl)ethyl]thiourea N-(2,5-Dithia-7-azabicyclo[2.2.1]hept-7-yl)-N'-[2-(2-pyridinyl)ethyl]thiourea
Wiley ID 1438844