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4-{{{5-[(cyclopropylmethyl)thio]-1,3,4-thiadiazol-2-yl}thio}methyl}-2-phenyl-5-thiazolecarboxylic acid, ethyl ester
SpectraBase Compound ID 2BJ232spCuJ
InChI InChI=1S/C19H19N3O2S4/c1-2-24-17(23)15-14(20-16(27-15)13-6-4-3-5-7-13)11-26-19-22-21-18(28-19)25-10-12-8-9-12/h3-7,12H,2,8-11H2,1H3
InChIKey PPSMMRHSUTVCEM-UHFFFAOYSA-N
Mol Weight 449.6 g/mol
Molecular Formula C19H19N3O2S4
Exact Mass 449.036012 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YBFjyj2gBU
Name 4-{{{5-[(cyclopropylmethyl)thio]-1,3,4-thiadiazol-2-yl}thio}methyl}-2-phenyl-5-thiazolecarboxylic acid, ethyl ester
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Formula C19H19N3O2S4
InChI InChI=1S/C19H19N3O2S4/c1-2-24-17(23)15-14(20-16(27-15)13-6-4-3-5-7-13)11-26-19-22-21-18(28-19)25-10-12-8-9-12/h3-7,12H,2,8-11H2,1H3
InChIKey PPSMMRHSUTVCEM-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 59082M
Solvent CDCl3