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5-OXO-3-N-PROPYL-4-PHENYLAMINO-4,5-DIHYDRO-[1,2,4]-TRIAZOL-1-YL-ACETIC-ACID-THIOPHENE-2-YL-METHYLENEHYDRAZIDE
SpectraBase Compound ID DnW1aVZmifR
InChI InChI=1S/2C18H20N6O2S/c2*1-2-7-16-22-23(13-17(25)20-19-12-15-10-6-11-27-15)18(26)24(16)21-14-8-4-3-5-9-14/h2*3-6,8-12,21H,2,7,13H2,1H3,(H,20,25)/b2*19-12+
InChIKey ULEAHUYYSBUDQL-BDCIMSLLSA-N
Mol Weight 768.92 g/mol
Molecular Formula C36H40N12O4S2
Exact Mass 768.27369 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID mtczANWVd5
Name 5-OXO-3-N-PROPYL-4-PHENYLAMINO-4,5-DIHYDRO-[1,2,4]-TRIAZOL-1-YL-ACETIC-ACID-THIOPHENE-2-YL-METHYLENEHYDRAZIDE
Compound Number 10E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H40N12O4S2
InChI InChI=1S/2C18H20N6O2S/c2*1-2-7-16-22-23(13-17(25)20-19-12-15-10-6-11-27-15)18(26)24(16)21-14-8-4-3-5-9-14/h2*3-6,8-12,21H,2,7,13H2,1H3,(H,20,25)/b2*19-12+
InChIKey ULEAHUYYSBUDQL-BDCIMSLLSA-N
Literature Reference Author A.DEMIRBAS
Literature Reference Citation TURK.J.CHEM.,28,311(2004)
Molecular Weight 768.912 g/mol
Solvent DMSO-D6
Source File Reference UWLU5947