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(E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-methoxyphenyl)-2-propenamide

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(E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-methoxyphenyl)-2-propenamide
SpectraBase Compound ID 9VlWwPgOpu1
InChI InChI=1S/C18H13N3O2S/c1-23-14-8-6-12(7-9-14)10-13(11-19)17(22)21-18-20-15-4-2-3-5-16(15)24-18/h2-10H,1H3,(H,20,21,22)/b13-10+
InChIKey ZEIRWRVJCUGRMB-JLHYYAGUSA-N
Mol Weight 335.38 g/mol
Molecular Formula C18H13N3O2S
Exact Mass 335.072848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaHoVo0xJYg
Name (E)-N-(1,3-Benzothiazol-2-yl)-2-cyano-3-(4-methoxyphenyl)-2-propenamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.072847843 u
Formula C18H13N3O2S
InChI InChI=1S/C18H13N3O2S/c1-23-14-8-6-12(7-9-14)10-13(11-19)17(22)21-18-20-15-4-2-3-5-16(15)24-18/h2-10H,1H3,(H,20,21,22)/b13-10+
InChIKey ZEIRWRVJCUGRMB-JLHYYAGUSA-N
Molecular Weight 335.381 g/mol
SMILES C1(=NC2=CC=CC=C2S1)NC(\C(=C\C=1C=CC(=CC1)OC)C#N)=O