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acetic acid, [(1-methyl-1H-benzimidazol-2-yl)thio]-, 2-[(E)-(3-methoxyphenyl)methylidene]hydrazide
SpectraBase Compound ID 3FjRA403Ea9
InChI InChI=1S/C18H18N4O2S/c1-22-16-9-4-3-8-15(16)20-18(22)25-12-17(23)21-19-11-13-6-5-7-14(10-13)24-2/h3-11H,12H2,1-2H3,(H,21,23)/b19-11+
InChIKey AGWKXNXAGDVJIR-YBFXNURJSA-N
Mol Weight 354.43 g/mol
Molecular Formula C18H18N4O2S
Exact Mass 354.115047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3lRcmiVpzFH
Name Acetic acid, [(1-methyl-1H-benzimidazol-2-yl)thio]-, 2-[(E)-(3-methoxyphenyl)methylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 354.115047008 u
Formula C18H18N4O2S
InChI InChI=1S/C18H18N4O2S/c1-22-16-9-4-3-8-15(16)20-18(22)25-12-17(23)21-19-11-13-6-5-7-14(10-13)24-2/h3-11H,12H2,1-2H3,(H,21,23)/b19-11+
InChIKey AGWKXNXAGDVJIR-YBFXNURJSA-N
Molecular Weight 354.428 g/mol
SMILES N(\N=C\C=1C=C(OC)C=CC1)C(CSC1=NC=2C=CC=CC2N1C)=O