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5-(1H-Indol-3-ylmethylidene)-3-phenyl-2-sulfanylimidazol-4-one

View entire compound with spectra: 1 NMR

5-(1H-Indol-3-ylmethylidene)-3-phenyl-2-sulfanylimidazol-4-one
SpectraBase Compound ID IcuFjniklW
InChI InChI=1S/C18H13N3OS/c22-17-16(10-12-11-19-15-9-5-4-8-14(12)15)20-18(23)21(17)13-6-2-1-3-7-13/h1-11,19H,(H,20,23)/b16-10+
InChIKey LPUMASDYXGPFNI-MHWRWJLKSA-N
Mol Weight 319.38 g/mol
Molecular Formula C18H13N3OS
Exact Mass 319.077933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4c8GspwHdby
Name 5-(1H-Indol-3-ylmethylidene)-3-phenyl-2-sulfanylimidazol-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.077933224 u
Formula C18H13N3OS
InChI InChI=1S/C18H13N3OS/c22-17-16(10-12-11-19-15-9-5-4-8-14(12)15)20-18(23)21(17)13-6-2-1-3-7-13/h1-11,19H,(H,20,23)/b16-10+
InChIKey LPUMASDYXGPFNI-MHWRWJLKSA-N
Molecular Weight 319.382 g/mol
SMILES C1=CC(=CC=C1)N1C(\C(N=C1S)=C/C1=CNC=2C=CC=CC12)=O