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3',5'-dichloro-2-{{4-methyl-5-[2-(3-thenyl)-4-thiazolyl]-4H-1,2,4-triazol-3-yl}thio}acetanilide
SpectraBase Compound ID Ct1QjFxDayH
InChI InChI=1S/C19H15Cl2N5OS3/c1-26-18(15-9-29-17(23-15)4-11-2-3-28-8-11)24-25-19(26)30-10-16(27)22-14-6-12(20)5-13(21)7-14/h2-3,5-9H,4,10H2,1H3,(H,22,27)
InChIKey ITQQDXRAQHFFAG-UHFFFAOYSA-N
Mol Weight 496.45 g/mol
Molecular Formula C19H15Cl2N5OS3
Exact Mass 494.981579 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1OFp3B1juHI
Name 3',5'-dichloro-2-{{4-methyl-5-[2-(3-thenyl)-4-thiazolyl]-4H-1,2,4-triazol-3-yl}thio}acetanilide
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Formula C19H15Cl2N5OS3
InChI InChI=1S/C19H15Cl2N5OS3/c1-26-18(15-9-29-17(23-15)4-11-2-3-28-8-11)24-25-19(26)30-10-16(27)22-14-6-12(20)5-13(21)7-14/h2-3,5-9H,4,10H2,1H3,(H,22,27)
InChIKey ITQQDXRAQHFFAG-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 58975M
Solvent Polysol