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Carbamic acid, N-[3-[[2-(4-morpholinyl)ethyl]amino]-3-phenyl-1-thioxo-2-propen-1-yl]-, ethyl ester
SpectraBase Compound ID 1mkca54Eo4L
InChI InChI=1S/C18H25N3O3S/c1-2-24-18(22)20-17(25)14-16(15-6-4-3-5-7-15)19-8-9-21-10-12-23-13-11-21/h3-7,14,19H,2,8-13H2,1H3,(H,20,22,25)/b16-14+
InChIKey QRUDLMZFSVAHHR-JQIJEIRASA-N
Mol Weight 363.48 g/mol
Molecular Formula C18H25N3O3S
Exact Mass 363.161663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GjlA3d3NvP4
Name Carbamic acid, N-[3-[[2-(4-morpholinyl)ethyl]amino]-3-phenyl-1-thioxo-2-propen-1-yl]-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.161662848 u
Formula C18H25N3O3S
InChI InChI=1S/C18H25N3O3S/c1-2-24-18(22)20-17(25)14-16(15-6-4-3-5-7-15)19-8-9-21-10-12-23-13-11-21/h3-7,14,19H,2,8-13H2,1H3,(H,20,22,25)/b16-14+
InChIKey QRUDLMZFSVAHHR-JQIJEIRASA-N
Molecular Weight 363.476 g/mol
SMILES CCOC(=O)NC(=S)\C=C/(NCCN1CCOCC1)C1=CC=CC=C1