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acetic acid, [[1-[(4-chlorophenyl)methyl]-1H-benzimidazol-2-yl]thio]-, 2-[(E)-phenylmethylidene]hydrazide
SpectraBase Compound ID FQdquL3Idst
InChI InChI=1S/C23H19ClN4OS/c24-19-12-10-18(11-13-19)15-28-21-9-5-4-8-20(21)26-23(28)30-16-22(29)27-25-14-17-6-2-1-3-7-17/h1-14H,15-16H2,(H,27,29)/b25-14+
InChIKey SHHVCJPIWKSIEM-AFUMVMLFSA-N
Mol Weight 434.95 g/mol
Molecular Formula C23H19ClN4OS
Exact Mass 434.09681 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LGowGI1fMbp
Name Acetic acid, [[1-[(4-chlorophenyl)methyl]-1H-benzimidazol-2-yl]thio]-, 2-[(E)-phenylmethylidene]hydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.096810121 u
Formula C23H19ClN4OS
InChI InChI=1S/C23H19ClN4OS/c24-19-12-10-18(11-13-19)15-28-21-9-5-4-8-20(21)26-23(28)30-16-22(29)27-25-14-17-6-2-1-3-7-17/h1-14H,15-16H2,(H,27,29)/b25-14+
InChIKey SHHVCJPIWKSIEM-AFUMVMLFSA-N
Molecular Weight 434.945 g/mol
SMILES N(\N=C\C=1C=CC=CC1)C(CSC=1N(C=2C=CC=CC2N1)CC=1C=CC(=CC1)Cl)=O