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1,3,4-Thiadiazol-2-amine, 5-[[[6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-pyridinyl]methyl]thio]-
SpectraBase Compound ID 7sz6MhNfkeY
InChI InChI=1S/C11H11N7S4/c12-8-15-17-10(21-8)19-4-6-2-1-3-7(14-6)5-20-11-18-16-9(13)22-11/h1-3H,4-5H2,(H2,12,15)(H2,13,16)
InChIKey SELRSWJLMRMQPQ-UHFFFAOYSA-N
Mol Weight 369.5 g/mol
Molecular Formula C11H11N7S4
Exact Mass 368.995878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HAbZEji9st
Name 1,3,4-Thiadiazol-2-amine, 5-[[[6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-pyridinyl]methyl]thio]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.995878078 u
Formula C11H11N7S4
InChI InChI=1S/C11H11N7S4/c12-8-15-17-10(21-8)19-4-6-2-1-3-7(14-6)5-20-11-18-16-9(13)22-11/h1-3H,4-5H2,(H2,12,15)(H2,13,16)
InChIKey SELRSWJLMRMQPQ-UHFFFAOYSA-N
Molecular Weight 369.498 g/mol
SMILES NC=1SC(SCC2=NC(CSC=3SC(=NN3)N)=CC=C2)=NN1