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N-Pyrrol5-[(3-chloro-4-methylphenylcarbamoyl) methylsulfanyl]-[1,3,4]thiadiazol-2-ylmorpho-2-methoxyacetamide

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N-Pyrrol5-[(3-chloro-4-methylphenylcarbamoyl) methylsulfanyl]-[1,3,4]thiadiazol-2-ylmorpho-2-methoxyacetamide
SpectraBase Compound ID 1WwefDF1g3Q
InChI InChI=1S/C14H15ClN4O3S2/c1-8-3-4-9(5-10(8)15)16-12(21)7-23-14-19-18-13(24-14)17-11(20)6-22-2/h3-5H,6-7H2,1-2H3,(H,16,21)(H,17,18,20)
InChIKey YCLJCFNGTBKYAD-UHFFFAOYSA-N
Mol Weight 386.87 g/mol
Molecular Formula C14H15ClN4O3S2
Exact Mass 386.02741 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HYp9EI9711A
Name N-Pyrrol5-[(3-chloro-4-methylphenylcarbamoyl) methylsulfanyl]-[1,3,4]thiadiazol-2-ylmorpho-2-methoxyacetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.027410404 u
Formula C14H15ClN4O3S2
InChI InChI=1S/C14H15ClN4O3S2/c1-8-3-4-9(5-10(8)15)16-12(21)7-23-14-19-18-13(24-14)17-11(20)6-22-2/h3-5H,6-7H2,1-2H3,(H,16,21)(H,17,18,20)
InChIKey YCLJCFNGTBKYAD-UHFFFAOYSA-N
Molecular Weight 386.872 g/mol
SMILES C=1(SC(SCC(NC2=CC(=C(C=C2)C)Cl)=O)=NN1)NC(COC)=O