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1H-benzimidazol-2-ylmethyl 5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl sulfide

View entire compound with spectra: 2 NMR

1H-benzimidazol-2-ylmethyl 5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl sulfide
SpectraBase Compound ID 9oZb30GTVP4
InChI InChI=1S/C18H17N5S/c1-23-17(11-13-7-3-2-4-8-13)21-22-18(23)24-12-16-19-14-9-5-6-10-15(14)20-16/h2-10H,11-12H2,1H3,(H,19,20)
InChIKey LZNMEIQTHMUNFW-UHFFFAOYSA-N
Mol Weight 335.43 g/mol
Molecular Formula C18H17N5S
Exact Mass 335.120467 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K2cEY7QCoyZ
Name 1H-Benzimidazol-2-ylmethyl 5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl sulfide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.120466741 u
Formula C18H17N5S
InChI InChI=1S/C18H17N5S/c1-23-17(11-13-7-3-2-4-8-13)21-22-18(23)24-12-16-19-14-9-5-6-10-15(14)20-16/h2-10H,11-12H2,1H3,(H,19,20)
InChIKey LZNMEIQTHMUNFW-UHFFFAOYSA-N
Molecular Weight 335.429 g/mol
SMILES N1C=2C=CC=CC2N=C1CSC=1N(C(=NN1)CC1=CC=CC=C1)C