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5,6-dimethoxy-N-[2-(phenylsulfinyl)ethyl]-1H-indazole-3-carboxamide

View entire compound with spectra: 2 NMR, and 1 FTIR

5,6-dimethoxy-N-[2-(phenylsulfinyl)ethyl]-1H-indazole-3-carboxamide
SpectraBase Compound ID 2PccMVx26o6
InChI InChI=1S/C18H19N3O4S/c1-24-15-10-13-14(11-16(15)25-2)20-21-17(13)18(22)19-8-9-26(23)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H,19,22)(H,20,21)
InChIKey FTURKUOGXZATMJ-UHFFFAOYSA-N
Mol Weight 373.43 g/mol
Molecular Formula C18H19N3O4S
Exact Mass 373.109627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2GfvSHo4PsM
Name 5,6-Dimethoxy-N-[2-(phenylsulfinyl)ethyl]-1H-indazole-3-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.109627274 u
Formula C18H19N3O4S
InChI InChI=1S/C18H19N3O4S/c1-24-15-10-13-14(11-16(15)25-2)20-21-17(13)18(22)19-8-9-26(23)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H,19,22)(H,20,21)
InChIKey FTURKUOGXZATMJ-UHFFFAOYSA-N
Molecular Weight 373.427 g/mol
SMILES N1C=2C=C(C(=CC2C(C(NCCS(=O)C=2C=CC=CC2)=O)=N1)OC)OC