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2-[1-(4-Chloro-phenyl)-1H-tetrazol-5-ylsulfanyl]-N-(5-methyl-[1,3,4]thiadiazol-2-yl)-acetamide
SpectraBase Compound ID 1GhqX8cltFR
InChI InChI=1S/C12H10ClN7OS2/c1-7-15-16-11(23-7)14-10(21)6-22-12-17-18-19-20(12)9-4-2-8(13)3-5-9/h2-5H,6H2,1H3,(H,14,16,21)
InChIKey UQIGEGYLDGSXPM-UHFFFAOYSA-N
Mol Weight 367.83 g/mol
Molecular Formula C12H10ClN7OS2
Exact Mass 367.007678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HFqOQhQpy3T
Name 2-[1-(4-Chloro-phenyl)-1H-tetrazol-5-ylsulfanyl]-N-(5-methyl-[1,3,4]thiadiazol-2-yl)-acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 367.007678017 u
Formula C12H10ClN7OS2
InChI InChI=1S/C12H10ClN7OS2/c1-7-15-16-11(23-7)14-10(21)6-22-12-17-18-19-20(12)9-4-2-8(13)3-5-9/h2-5H,6H2,1H3,(H,14,16,21)
InChIKey UQIGEGYLDGSXPM-UHFFFAOYSA-N
Molecular Weight 367.833 g/mol
SMILES CC=1SC(NC(CSC=2N(C=3C=CC(=CC3)Cl)N=NN2)=O)=NN1