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N-(5-{2-[(2E)-2-benzylidenehydrazino]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-2-methylbenzamide

View entire compound with spectra: 2 NMR

N-(5-{2-[(2E)-2-benzylidenehydrazino]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-2-methylbenzamide
SpectraBase Compound ID FRJdLpDYMMD
InChI InChI=1S/C19H17N5O2S/c1-13-7-5-6-10-15(13)18(26)21-19-24-23-17(27-19)11-16(25)22-20-12-14-8-3-2-4-9-14/h2-10,12H,11H2,1H3,(H,22,25)(H,21,24,26)/b20-12+
InChIKey BNHXOPJABYTJSY-UDWIEESQSA-N
Mol Weight 379.44 g/mol
Molecular Formula C19H17N5O2S
Exact Mass 379.110296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ELhgaTqMnSD
Name N-(5-{2-[(2E)-2-Benzylidenehydrazino]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-2-methylbenzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.110295979 u
Formula C19H17N5O2S
InChI InChI=1S/C19H17N5O2S/c1-13-7-5-6-10-15(13)18(26)21-19-24-23-17(27-19)11-16(25)22-20-12-14-8-3-2-4-9-14/h2-10,12H,11H2,1H3,(H,22,25)(H,21,24,26)/b20-12+
InChIKey BNHXOPJABYTJSY-UDWIEESQSA-N
Molecular Weight 379.438 g/mol
SMILES N(\N=C\C1=CC=CC=C1)C(CC=1SC(=NN1)NC(C1=C(C)C=CC=C1)=O)=O