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3-Thio-4-m-tolyl-1-(3,4,5-trimethoxybenzoyl)semicarbazide

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

3-Thio-4-m-tolyl-1-(3,4,5-trimethoxybenzoyl)semicarbazide
SpectraBase Compound ID JzAAqB0mln2
InChI InChI=1S/C18H21N3O4S/c1-11-6-5-7-13(8-11)19-18(26)21-20-17(22)12-9-14(23-2)16(25-4)15(10-12)24-3/h5-10H,1-4H3,(H,20,22)(H2,19,21,26)
InChIKey TWGATJFWDVYABE-UHFFFAOYSA-N
Mol Weight 375.44 g/mol
Molecular Formula C18H21N3O4S
Exact Mass 375.125277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2KOFF1TOvGO
Name 3-Thio-4-m-tolyl-1-(3,4,5-trimethoxybenzoyl)semicarbazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 375.125277338 u
Formula C18H21N3O4S
InChI InChI=1S/C18H21N3O4S/c1-11-6-5-7-13(8-11)19-18(26)21-20-17(22)12-9-14(23-2)16(25-4)15(10-12)24-3/h5-10H,1-4H3,(H,20,22)(H2,19,21,26)
InChIKey TWGATJFWDVYABE-UHFFFAOYSA-N
Molecular Weight 375.443 g/mol
SMILES N(C1=CC=CC(=C1)C)C(NNC(C=1C=C(C(=C(OC)C1)OC)OC)=O)=S