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(2Z)-3-benzyl-2-[(4-methoxyphenyl)imino]-4-oxo-N-(4-propoxyphenyl)tetrahydro-2H-1,3-thiazine-6-carboxamide
SpectraBase Compound ID 2ScZCLYDGu4
InChI InChI=1S/C28H29N3O4S/c1-3-17-35-24-15-11-21(12-16-24)29-27(33)25-18-26(32)31(19-20-7-5-4-6-8-20)28(36-25)30-22-9-13-23(34-2)14-10-22/h4-16,25H,3,17-19H2,1-2H3,(H,29,33)/b30-28-
InChIKey JFAQMEJPGPCHQW-HYOGKJQXSA-N
Mol Weight 503.62 g/mol
Molecular Formula C28H29N3O4S
Exact Mass 503.187878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CwxjCDkeVfI
Name (2Z)-3-Benzyl-2-[(4-methoxyphenyl)imino]-4-oxo-N-(4-propoxyphenyl)tetrahydro-2H-1,3-thiazine-6-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 503.187877596 u
Formula C28H29N3O4S
InChI InChI=1S/C28H29N3O4S/c1-3-17-35-24-15-11-21(12-16-24)29-27(33)25-18-26(32)31(19-20-7-5-4-6-8-20)28(36-25)30-22-9-13-23(34-2)14-10-22/h4-16,25H,3,17-19H2,1-2H3,(H,29,33)/b30-28-
InChIKey JFAQMEJPGPCHQW-HYOGKJQXSA-N
Molecular Weight 503.617 g/mol
SMILES N(C(C1CC(N(\C(S1)=N\C1=CC=C(C=C1)OC)CC=1C=CC=CC1)=O)=O)C=1C=CC(=CC1)OCCC